data_2mq0_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 2mq0 _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 ' 453' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 N--CA 1.457 -0.643 0 CA-C-O 120.916 0.298 . . . . 73.44 112.267 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.53 ' HB ' ' HB2' ' A' ' 530' ' ' SER . 65.6 t -65.94 108.78 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.295 -0.631 . . . . 73.43 109.295 172.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 54.7 tp -95.15 137.29 34.4 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.426 -0.807 . . . . 71.13 110.269 -175.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 58.1 mt -80.29 101.48 5.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.072 -0.714 . . . . 73.22 109.072 175.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 6.5 p -74.42 -18.97 60.57 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.909 -0.587 . . . . 62.42 111.964 -173.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . . . . . . . . . 36.7 tpt85 -122.97 108.08 32.8 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.438 -0.346 . . . . 74.22 110.122 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.92 158.95 27.1 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 123.146 2.564 . . . . 73.25 112.48 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.585 ' HB3' ' HB3' ' A' ' 536' ' ' ALA . 94.9 mt -80.93 160.81 24.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.888 -0.596 . . . . 60.31 111.459 -174.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . 0.662 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 0.1 OUTLIER -65.91 139.59 58.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.652 -0.703 . . . . 71.43 112.069 -175.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -106.12 10.74 31.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.92 -1.037 . . . . 62.22 112.331 -173.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . 0.402 ' OE1' ' HG3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -120.63 153.03 37.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 119.685 -0.806 . . . . 72.34 112.362 -163.733 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.2 pt? -91.7 146.7 23.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.164 -1.38 . . . . 75.4 112.072 -169.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.504 HG22 HG22 ' A' ' 540' ' ' VAL . 28.2 m -125.32 178.43 3.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.822 -0.627 . . . . 65.42 111.121 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -118.36 161.65 19.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.095 -0.502 . . . . 75.22 110.775 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 52.7 t -66.17 126.59 25.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 74.03 110.738 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 95.13 -3.97 67.2 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.75 -0.738 . . . . 75.01 112.304 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -104.91 150.61 24.73 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.89 -0.411 . . . . 74.21 109.89 178.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . 0.461 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 17.3 ptp180 -81.58 153.19 26.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.984 0.421 . . . . 74.13 110.957 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.449 HG23 HG21 ' A' ' 465' ' ' VAL . 2.3 t -120.57 119.33 59.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.044 -0.525 . . . . 72.52 109.93 177.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -106.02 119.18 38.54 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.064 -0.347 . . . . 64.13 110.064 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.662 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 98.3 m-85 -108.85 139.31 43.86 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.884 -0.598 . . . . 64.35 110.28 174.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.95 123.85 50.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.544 -0.298 . . . . 73.22 110.31 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 26.8 p -149.39 135.44 18.94 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.912 0.387 . . . . 75.01 110.479 177.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.41 ' HA ' ' HA ' ' A' ' 509' ' ' ARG . 43.8 mt-10 -128.18 155.52 44.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.895 -0.593 . . . . 73.31 109.437 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.452 HG21 ' HB3' ' A' ' 482' ' ' ALA . 14.2 m -125.3 166.68 20.66 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 116.424 -0.353 . . . . 74.51 110.461 177.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 25.8 p -78.93 8.4 5.64 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.438 0.533 . . . . 61.21 112.438 -174.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . 0.519 ' HB3' ' HB1' ' A' ' 482' ' ' ALA . 37.1 tt0 -144.54 133.93 23.19 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.048 -0.353 . . . . 75.32 110.048 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -79.0 134.11 36.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.317 0.579 . . . . 72.02 110.731 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . 0.504 ' HA2' ' HD3' ' A' ' 505' ' ' LYS . . . 71.4 16.28 75.48 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.47 -0.786 . . . . 72.24 112.118 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.519 ' HB1' ' HB3' ' A' ' 479' ' ' GLU . . . -61.56 156.54 19.41 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.146 0.498 . . . . 61.34 111.821 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -81.25 133.6 35.47 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.344 -0.844 . . . . 74.42 109.878 -178.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.518 ' HB ' HD11 ' A' ' 527' ' ' LEU . 26.8 m -137.36 175.53 9.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.892 0.377 . . . . 74.04 110.858 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . 0.547 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 55.9 tttp -151.31 122.63 7.8 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.306 -0.627 . . . . 74.25 109.306 -177.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -101.92 120.1 39.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.858 0.361 . . . . 72.2 111.143 -176.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . 0.493 HD22 ' HE3' ' A' ' 485' ' ' LYS . 98.0 mt -120.45 135.51 55.03 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.911 -0.586 . . . . 73.15 110.411 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.648 ' HZ2' ' HA ' ' A' ' 521' ' ' ASP . 5.2 tmmm? -111.88 104.77 13.09 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.572 -0.899 . . . . 74.34 108.572 174.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.31 36.66 16.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.598 -0.728 . . . . 65.32 110.877 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.08 -14.11 61.53 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.833 -0.698 . . . . 64.41 113.266 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 39.9 t -100.76 123.2 53.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 122.47 -0.429 . . . . 71.42 110.43 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -71.77 135.69 46.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.98 0.419 . . . . 74.13 110.78 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 91.1 mt -78.42 128.26 33.36 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.953 -0.567 . . . . 74.01 110.125 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 11.8 t -80.88 138.9 36.17 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.13 0.49 . . . . 75.02 110.036 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . 0.597 ' HA ' HG23 ' A' ' 498' ' ' THR . 0.0 OUTLIER -126.02 14.24 7.9 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.834 -0.621 . . . . 73.45 110.043 -178.01 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -70.49 -34.22 72.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.478 0.656 . . . . 65.43 109.304 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -144.69 107.21 4.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.014 -0.994 . . . . 75.12 109.014 173.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' THR . . . . . 0.597 HG23 ' HA ' ' A' ' 495' ' ' ARG . 22.6 p -120.21 114.87 22.56 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.221 -0.445 . . . . 73.12 111.205 -176.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -111.82 -18.97 12.58 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.045 0.45 . . . . 75.33 111.039 170.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -99.38 -42.84 6.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.06 -0.518 . . . . 71.52 111.136 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.478 ' O ' ' HB ' ' A' ' 498' ' ' THR . 46.4 m-85 -107.64 138.54 43.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.368 -0.378 . . . . 74.31 110.611 -176.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 502' ' ' ARG . . . . . 0.503 ' HB2' ' CG2' ' A' ' 513' ' ' ILE . 0.8 OUTLIER -118.34 123.95 46.58 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.704 0.288 . . . . 73.3 110.418 175.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . 0.422 ' CE2' HD11 ' A' ' 512' ' ' LEU . 89.5 m-85 -103.1 112.84 25.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.743 -0.662 . . . . 72.23 109.615 178.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.479 ' HE2' HG21 ' A' ' 513' ' ' ILE . 0.0 OUTLIER -113.79 135.82 53.54 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.978 0.418 . . . . 71.13 111.005 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.504 ' HD3' ' HA2' ' A' ' 481' ' ' GLY . 20.4 ttmt -115.15 111.89 21.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.537 -0.756 . . . . 70.4 109.699 177.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -119.58 88.17 2.88 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.542 -0.54 . . . . 73.12 109.542 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.65 -106.45 1.76 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.611 -0.805 . . . . 70.22 112.107 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -101.54 -15.9 16.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.582 0.229 . . . . 65.44 110.701 -177.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.41 ' HA ' ' HA ' ' A' ' 476' ' ' GLU . 26.6 ptt180 -89.76 151.54 21.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.196 0.522 . . . . 74.24 110.219 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 -132.06 136.35 47.14 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.012 -0.736 . . . . 73.03 109.012 175.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -123.9 124.09 41.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.008 0.432 . . . . 73.05 111.473 177.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.465 HD13 ' HB3' ' A' ' 501' ' ' TYR . 53.1 tp -105.46 102.72 12.17 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.19 -1.041 . . . . 74.34 108.19 169.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.503 ' CG2' ' HB2' ' A' ' 502' ' ' ARG . 8.0 tp -98.68 113.2 32.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.668 0.746 . . . . 73.5 109.8 -179.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.461 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 60.5 mt -88.6 115.96 29.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.309 -0.86 . . . . 73.45 109.365 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -63.81 -45.37 89.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.882 0.372 . . . . 73.21 111.056 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -141.83 110.91 6.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.95 -0.568 . . . . 73.13 110.074 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -83.29 137.14 34.11 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.09 -0.505 . . . . 73.33 110.953 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 518' ' ' MET . . . . . 0.59 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 26.3 mmt -107.72 170.78 7.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.919 -0.582 . . . . 72.25 110.086 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -64.07 -54.68 30.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.178 0.513 . . . . 73.31 110.808 -173.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -82.77 -4.84 58.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.645 -0.707 . . . . 74.34 111.089 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . 0.648 ' HA ' ' HZ2' ' A' ' 488' ' ' LYS . 1.0 OUTLIER -89.3 -7.49 55.28 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.081 -0.508 . . . . 74.44 111.509 -178.496 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.473 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -74.4 -43.72 55.16 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.76 -0.376 . . . . 53.25 111.371 -177.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 41.41 -158.11 0.04 OUTLIER Glycine 0 CA--C 1.526 0.767 0 CA-C-O 121.95 0.75 . . . . 73.12 114.845 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -111.51 113.79 26.45 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.07 -0.715 . . . . 75.03 109.07 169.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . 0.578 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 60.6 m-85 -84.35 130.95 34.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.083 0.468 . . . . 72.43 110.207 -178.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -137.87 119.65 15.21 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.657 -0.701 . . . . 72.11 110.276 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.518 HD11 ' HB ' ' A' ' 484' ' ' VAL . 33.7 tp -89.78 109.59 20.57 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.255 -0.646 . . . . 73.21 109.255 178.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . 0.547 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 60.3 m -94.83 113.97 25.78 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.302 0.572 . . . . 75.13 110.24 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.553 ' C ' ' H ' ' A' ' 531' ' ' GLY . 55.8 p -116.13 -165.92 1.09 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.408 -0.815 . . . . 75.53 110.973 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 530' ' ' SER . . . . . 0.53 ' HB2' ' HB ' ' A' ' 454' ' ' VAL . 33.1 m -52.87 5.05 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.451 1.1 . . . . 63.15 113.729 172.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . 0.553 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.79 27.44 1.91 Allowed Glycine 0 C--N 1.33 0.224 0 O-C-N 122.018 -0.426 . . . . 75.15 113.357 -177.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -111.75 134.58 12.18 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 109.658 -1.377 . . . . 73.3 109.658 164.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -119.09 120.54 37.45 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 117.193 0.496 . . . . 62.0 111.685 -172.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -121.3 143.3 49.25 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.799 -0.815 . . . . 60.31 108.799 171.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.434 HD11 ' N ' ' A' ' 536' ' ' ALA . 2.4 tm? -128.54 133.56 48.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.001 0.429 . . . . 65.03 110.384 -174.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 460' ' ' LEU . . . -127.65 131.11 49.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.915 -0.584 . . . . 73.42 110.272 176.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -113.49 115.7 28.43 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.19 -0.671 . . . . 75.55 109.19 176.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.446 HD12 HG23 ' A' ' 465' ' ' VAL . 37.6 tp -109.46 134.61 51.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.991 -0.55 . . . . 73.02 110.349 -173.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.505 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 43.1 mt -119.86 113.69 41.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.375 -0.602 . . . . 75.21 109.375 175.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.504 HG22 HG22 ' A' ' 465' ' ' VAL . 85.7 t -103.89 134.66 44.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.831 -0.433 . . . . 72.44 109.831 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.36 146.07 49.58 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.295 -0.411 . . . . 74.05 110.057 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -83.4 109.31 17.21 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.939 -0.763 . . . . 75.32 108.939 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.764 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 10.9 mmpt? . . . . . 0 C--O 1.245 0.846 0 CA-C-O 118.306 -0.854 . . . . 73.22 109.753 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo . . . . . 0 N--CA 1.456 -0.696 0 N-CA-C 110.04 -0.792 . . . . 72.42 110.04 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.414 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 92.2 t -64.36 107.6 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.37 0.605 . . . . 72.44 110.213 -176.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 44.1 tp -106.14 162.38 13.68 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.165 -0.925 . . . . 74.21 109.465 -177.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 34.1 mt -104.58 107.54 22.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 110.041 -0.355 . . . . 74.24 110.041 -177.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' THR . . . . . 0.492 ' O ' ' HD3' ' A' ' 459' ' ' PRO . 21.4 p -80.57 -44.01 19.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.316 0.579 . . . . 72.33 110.367 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.449 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 8.1 tpt85 -99.79 101.63 14.48 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 115.383 -0.826 . . . . 72.24 109.18 175.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . 0.492 ' HD3' ' O ' ' A' ' 457' ' ' THR . 17.0 Cg_exo -67.36 165.18 27.83 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.726 2.284 . . . . 71.42 111.493 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.685 ' HB2' ' HB1' ' A' ' 536' ' ' ALA . 3.2 mm? -65.86 166.45 11.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.357 -0.383 . . . . 75.44 110.395 -179.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . 0.41 ' OE1' ' HA ' ' A' ' 461' ' ' GLU . 1.4 tp10 -69.87 157.17 37.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.481 0.657 . . . . 75.42 112.255 -172.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -105.49 7.67 33.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.883 -1.053 . . . . 74.12 113.649 -168.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -123.41 153.63 40.14 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.162 -1.015 . . . . 74.11 112.423 -167.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.649 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 1.8 pt? -108.75 145.47 35.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.177 -1.374 . . . . 72.33 110.89 -171.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.553 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 27.5 m -124.19 176.83 5.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.078 0.466 . . . . 73.44 111.21 -178.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -100.14 166.7 10.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.786 -0.643 . . . . 65.32 110.358 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . 0.404 HG21 ' HG2' ' A' ' 542' ' ' GLU . 24.5 t -60.03 138.25 21.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.329 -0.396 . . . . 73.43 111.254 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 82.18 -4.05 78.25 Favored Glycine 0 C--N 1.329 0.185 0 C-N-CA 121.192 -0.528 . . . . 71.01 112.809 176.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -102.46 143.32 32.34 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.181 -0.303 . . . . 75.44 110.181 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . 0.521 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 1.1 ptp180 -72.02 147.98 46.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.269 -0.423 . . . . 72.13 110.885 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.483 ' HB ' HG23 ' A' ' 465' ' ' VAL . 7.5 p -140.91 133.71 31.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.999 -0.546 . . . . 74.34 109.684 174.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.556 ' HG2' HD12 ' A' ' 513' ' ' ILE . 44.3 mt-10 -100.95 132.48 46.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.017 0.437 . . . . 71.55 110.968 -178.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.532 ' HB3' HD11 ' A' ' 460' ' ' LEU . 80.6 m-85 -124.09 112.28 16.94 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.042 -0.725 . . . . 74.01 109.042 169.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -118.52 138.65 52.38 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.102 0.477 . . . . 60.43 110.619 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.441 ' HB3' HD13 ' A' ' 460' ' ' LEU . 7.4 p -138.91 146.38 41.0 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.628 -0.714 . . . . 70.44 110.518 -178.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.585 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 44.3 mt-10 -116.38 138.08 51.64 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.213 -0.448 . . . . 75.2 109.821 176.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 479' ' ' GLU . 14.2 m -119.27 164.83 15.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.86 -0.609 . . . . 74.13 110.874 -179.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 7.9 m -66.19 -12.87 58.75 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.723 0.638 . . . . 62.14 112.723 -174.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . 0.532 ' HB3' ' HB3' ' A' ' 482' ' ' ALA . 40.8 tt0 -129.33 145.23 51.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.733 0.301 . . . . 75.13 110.847 -176.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . 0.441 ' H ' ' CD ' ' A' ' 480' ' ' GLU . 0.6 OUTLIER -79.69 126.95 31.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.188 -0.46 . . . . 72.12 110.541 -179.317 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 64.0 25.86 69.75 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.962 -0.637 . . . . 62.22 112.049 -176.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.532 ' HB3' ' HB3' ' A' ' 479' ' ' GLU . . . -58.44 152.9 16.92 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.148 0.499 . . . . 75.44 112.129 -177.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -76.32 111.95 12.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.26 -0.882 . . . . 73.44 109.875 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.537 ' HB ' HD12 ' A' ' 527' ' ' LEU . 35.2 m -124.98 150.72 30.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.172 -0.467 . . . . 64.15 111.077 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 528' ' ' CYS . 45.4 tttp -121.86 129.72 52.81 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.177 -0.675 . . . . 74.01 109.177 179.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -101.17 126.84 47.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.644 0.259 . . . . 73.51 110.477 -178.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . 0.432 HD13 ' HD3' ' A' ' 485' ' ' LYS . 5.1 mp -131.44 150.96 51.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.355 0.598 . . . . 62.21 111.194 -179.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.566 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 5.8 tmmm? -129.6 107.78 9.71 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.95 -1.023 . . . . 73.31 108.517 173.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.93 35.28 26.16 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.036 -0.529 . . . . 74.24 111.328 -176.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 95.96 -20.91 47.85 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.952 -0.642 . . . . 75.21 112.735 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 62.1 t -85.02 122.84 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 110.225 -0.287 . . . . 74.55 110.225 -177.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -69.06 132.18 46.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.344 -0.389 . . . . 75.41 110.651 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 79.9 mt -87.11 104.72 16.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.83 -0.623 . . . . 62.55 110.07 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 9.7 t -69.64 160.94 30.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.304 0.573 . . . . 63.42 111.206 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . 0.606 ' HA ' HG21 ' A' ' 498' ' ' THR . 0.0 OUTLIER -117.84 -3.45 11.21 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.624 -0.717 . . . . 75.3 109.5 179.689 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -60.82 -39.18 88.01 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.253 -0.885 . . . . 65.14 110.397 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . 0.418 ' O ' ' HG3' ' A' ' 497' ' ' GLU . 8.1 pt-20 -127.55 108.26 10.64 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.101 -0.704 . . . . 72.45 109.101 167.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' THR . . . . . 0.606 HG21 ' HA ' ' A' ' 495' ' ' ARG . 0.7 OUTLIER -122.29 88.0 2.85 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.389 0.614 . . . . 74.04 111.235 -176.593 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -100.91 -27.4 13.33 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.42 -0.809 . . . . 64.44 109.078 175.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -95.43 -47.32 6.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.208 -0.906 . . . . 74.43 111.026 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.444 ' O ' ' HD2' ' A' ' 502' ' ' ARG . 13.8 m-85 -103.21 148.41 25.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.2 -0.455 . . . . 74.31 110.622 -176.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 502' ' ' ARG . . . . . 0.444 ' HD2' ' O ' ' A' ' 501' ' ' TYR . 1.5 mpt_? -132.58 137.69 47.17 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.558 -0.534 . . . . 75.33 109.558 171.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -111.94 118.55 35.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.654 0.264 . . . . 72.35 110.799 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 1.4 mptm? -111.83 145.37 39.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.68 0.276 . . . . 72.13 110.354 176.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -123.35 117.57 25.52 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.318 -0.401 . . . . 74.43 110.787 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . 0.442 ' HB2' ' HG3' ' A' ' 509' ' ' ARG . 42.2 m-20 -121.27 77.7 1.35 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.631 -0.507 . . . . 73.23 109.631 173.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 64.84 -109.26 2.75 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.648 -0.786 . . . . 43.41 112.034 -178.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -85.91 -24.66 26.52 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.769 -0.254 . . . . 74.54 111.091 -177.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.585 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 29.6 ptt180 -92.95 132.41 37.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.616 0.722 . . . . 54.21 110.93 -177.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -114.94 143.98 44.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.519 -0.764 . . . . 73.53 109.28 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 25.6 m-70 -119.22 127.62 53.44 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.844 -0.343 . . . . 71.14 110.803 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.403 HD13 ' HB3' ' A' ' 501' ' ' TYR . 65.4 tp -107.03 102.94 12.25 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.363 -0.977 . . . . 71.24 108.363 168.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.556 HD12 ' HG2' ' A' ' 472' ' ' GLU . 5.8 tp -103.47 115.46 45.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.518 0.675 . . . . 63.2 110.242 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.521 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 34.0 mt -95.27 112.74 28.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.631 -0.713 . . . . 71.32 109.221 177.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -73.76 -43.12 59.97 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.076 0.465 . . . . 73.34 110.048 -176.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -128.67 108.54 10.57 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.548 -0.751 . . . . 73.21 109.519 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -91.48 138.23 31.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.109 -0.496 . . . . 55.14 110.25 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 26.5 mmt -118.84 175.18 5.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.203 -0.453 . . . . 71.3 110.012 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -64.99 -53.91 38.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.34 -0.391 . . . . 74.53 111.089 -173.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -80.01 -18.5 50.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.128 0.49 . . . . 73.11 110.716 -178.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.29 -33.34 71.45 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.048 -0.524 . . . . 64.25 111.755 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.439 ' HB1' ' CG2' ' A' ' 540' ' ' VAL . . . -64.4 -44.5 91.08 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.865 0.32 . . . . 71.42 111.865 -175.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . 0.566 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 40.47 -157.55 0.03 OUTLIER Glycine 0 CA--C 1.525 0.673 0 O-C-N 123.911 0.757 . . . . 43.22 114.818 175.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 53.7 m80 -105.88 112.45 25.51 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.471 -0.937 . . . . 72.42 108.471 169.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -85.45 131.45 34.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.259 0.552 . . . . 72.44 111.262 -175.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.28 131.42 34.4 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.301 -0.863 . . . . 75.12 110.558 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.537 HD12 ' HB ' ' A' ' 484' ' ' VAL . 37.3 tp -99.62 115.16 28.77 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.438 -0.578 . . . . 74.32 109.438 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 485' ' ' LYS . 48.4 t -100.16 112.87 25.2 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.702 -0.481 . . . . 74.33 109.702 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.567 ' C ' ' H ' ' A' ' 531' ' ' GLY . 61.2 p -111.51 -165.0 0.95 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.886 -0.597 . . . . 73.34 110.625 -178.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 11.9 m -51.09 6.06 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.611 1.164 . . . . 73.5 113.961 171.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . 0.567 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.42 28.88 1.54 Allowed Glycine 0 C--N 1.332 0.348 0 O-C-N 121.952 -0.467 . . . . 64.54 113.253 -175.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -113.4 141.76 17.1 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 109.974 -1.25 . . . . 74.32 109.974 167.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.4 tp60 -128.84 121.96 29.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.461 0.63 . . . . 63.11 112.096 -173.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -131.14 132.16 44.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.581 -0.736 . . . . 55.13 109.274 170.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -118.81 124.38 47.05 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.032 -0.358 . . . . 75.25 110.032 -176.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.685 ' HB1' ' HB2' ' A' ' 460' ' ' LEU . . . -118.69 159.13 24.2 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.136 -0.484 . . . . 74.53 110.215 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -127.36 123.12 35.51 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.92 0.391 . . . . 75.24 110.815 -176.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.519 HD11 ' HA ' ' A' ' 464' ' ' LEU . 54.8 tp -112.12 121.48 45.08 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.878 -0.601 . . . . 75.22 109.723 176.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.649 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.5 mp -108.26 107.66 23.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 109.016 -0.735 . . . . 74.54 109.016 176.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 465' ' ' VAL . 42.2 t -94.79 122.82 46.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.32 0.581 . . . . 74.32 110.37 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . 0.449 ' HB3' ' HE3' ' A' ' 543' ' ' LYS . 7.5 mt-30 -114.64 160.54 19.21 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.98 -1.009 . . . . 74.31 110.166 -176.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . 0.404 ' HG2' HG21 ' A' ' 467' ' ' VAL . 46.6 mt-10 -105.95 106.76 17.42 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.949 -0.76 . . . . 64.44 108.949 174.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.449 ' HE3' ' HB3' ' A' ' 541' ' ' GLN . 17.2 ptpt . . . . . 0 C--O 1.245 0.854 0 CA-C-N 116.293 -0.412 . . . . 55.53 110.137 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo . . . . . 0 N--CA 1.454 -0.83 0 N-CA-C 109.656 -0.94 . . . . 74.41 109.656 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.531 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 55.1 t -68.52 106.69 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 120.889 0.376 . . . . 61.51 110.158 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 52.6 tp -87.64 138.75 31.2 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.943 -0.571 . . . . 74.3 110.348 -178.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . 0.43 HD12 HD22 ' A' ' 527' ' ' LEU . 32.7 mt -91.75 113.3 26.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.563 -0.744 . . . . 75.05 109.458 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' THR . . . . . 0.434 ' OG1' ' HB2' ' A' ' 476' ' ' GLU . 28.6 p -77.29 -45.86 24.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.929 0.395 . . . . 74.03 110.808 -176.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.401 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 12.1 tpt180 -92.1 111.03 48.09 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.994 -0.548 . . . . 71.12 109.857 176.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -68.81 149.67 73.01 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.491 2.127 . . . . 65.14 111.109 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.723 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 4.0 mm? -66.2 158.94 27.51 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.316 -0.402 . . . . 75.42 110.792 -178.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . 0.518 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 1.8 mp0 -65.12 144.41 57.25 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.97 0.891 . . . . 61.13 112.709 -172.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -104.77 9.13 35.07 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.049 -1.432 . . . . 74.33 111.729 -174.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . 0.493 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -121.44 154.36 36.65 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 122.214 1.006 . . . . 73.41 112.894 -160.256 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -90.86 147.08 23.41 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 113.4 -1.727 . . . . 75.44 112.206 -167.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.517 HG12 ' HB ' ' A' ' 471' ' ' VAL . 27.4 m -126.68 178.0 4.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.45 -0.795 . . . . 71.42 110.076 175.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 51.4 mtm -118.16 158.65 24.69 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.245 -0.434 . . . . 64.25 110.82 -178.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 51.4 t -50.95 128.6 8.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.653 -0.703 . . . . 72.31 111.72 -176.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 89.39 -16.04 57.06 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 115.838 -0.619 . . . . 72.14 113.337 174.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -83.17 135.09 34.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 117.038 0.419 . . . . 74.55 110.792 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . 0.527 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 2.0 ptm180 -66.33 126.52 29.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.63 -0.714 . . . . 74.31 110.61 175.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.517 ' HB ' HG12 ' A' ' 465' ' ' VAL . 5.2 p -113.16 137.94 44.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.749 -0.463 . . . . 72.34 109.749 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.454 ' HB2' ' NH2' ' A' ' 470' ' ' ARG . 30.4 tt0 -120.49 124.02 44.39 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.785 -0.643 . . . . 72.32 110.515 -173.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.518 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 97.4 m-85 -110.28 141.07 43.78 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.905 -0.589 . . . . 71.52 109.557 176.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -119.2 134.97 54.9 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.903 0.382 . . . . 73.01 110.234 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 27.1 p -146.93 126.55 13.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.368 -0.378 . . . . 61.22 110.392 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.434 ' HB2' ' OG1' ' A' ' 457' ' ' THR . 31.4 mt-10 -110.77 137.66 48.14 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.82 -0.807 . . . . 75.03 108.82 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 508' ' ' GLN . 27.8 m -119.48 152.63 22.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 C-N-CA 120.562 -0.455 . . . . 71.43 110.653 177.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 16.1 m -66.68 -26.04 66.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.66 -0.7 . . . . 63.22 111.718 -175.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . 0.415 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 37.8 tt0 -106.42 118.18 35.98 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.865 -0.42 . . . . 70.53 109.865 -178.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . 0.794 ' HB3' ' HG2' ' A' ' 508' ' ' GLN . 10.0 pt-20 -76.19 134.34 39.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.093 0.473 . . . . 73.45 110.893 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 72.68 21.18 79.78 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.696 -0.684 . . . . 63.5 112.092 -176.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.415 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -73.28 150.84 41.64 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.88 0.372 . . . . 74.3 111.452 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -81.72 114.53 20.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.551 -0.75 . . . . 71.1 110.438 178.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.502 HG12 HG23 ' A' ' 529' ' ' THR . 21.2 m -125.84 150.64 31.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 70.45 109.862 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . 0.477 ' HE2' HD11 ' A' ' 487' ' ' LEU . 21.0 ptmt -125.61 140.44 52.73 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.065 0.459 . . . . 74.23 110.749 177.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -102.01 125.78 48.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.621 -0.718 . . . . 73.05 110.222 -179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . 0.477 HD11 ' HE2' ' A' ' 485' ' ' LYS . 5.7 mp -114.13 136.4 52.98 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.063 -0.517 . . . . 71.31 110.379 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.15 105.46 12.62 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.813 -1.181 . . . . 72.14 107.813 174.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 57.12 34.04 24.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.993 -0.549 . . . . 73.31 110.691 -174.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.25 -18.88 56.65 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.001 -0.619 . . . . 62.15 112.906 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 45.5 t -83.09 127.45 39.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 110.328 -0.249 . . . . 71.33 110.328 -178.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -72.24 126.56 30.12 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.47 -0.567 . . . . 73.41 109.47 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.474 HD11 ' HE2' ' A' ' 525' ' ' TYR . 77.3 mt -66.04 106.43 1.61 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.141 0.496 . . . . 74.22 110.641 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 9.8 t -73.45 141.52 46.87 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 115.586 -0.734 . . . . 74.25 110.751 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . 0.471 ' N ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -107.7 13.12 26.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.694 -0.685 . . . . 74.33 110.264 -179.04 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -59.96 -56.61 19.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.8 -0.637 . . . . 60.34 109.644 174.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -137.78 118.39 13.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.729 -0.668 . . . . 75.4 109.913 173.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.2 108.56 5.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.076 -0.511 . . . . 74.01 110.42 -178.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -104.47 -22.22 13.33 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.284 0.564 . . . . 74.23 110.098 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -92.87 -34.47 13.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.744 -0.662 . . . . 73.51 111.611 -177.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.402 ' HD1' HG12 ' A' ' 514' ' ' ILE . 8.0 m-85 -115.77 141.51 48.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.617 -0.265 . . . . 73.03 110.309 -174.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -132.52 126.42 32.86 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.87 0.366 . . . . 74.21 110.128 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -96.43 113.63 25.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.803 -0.635 . . . . 73.21 110.819 -174.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 42.1 mttm -109.64 124.41 51.13 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.101 -0.5 . . . . 63.51 111.246 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -103.92 111.15 23.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.022 -0.535 . . . . 75.31 109.984 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -120.03 87.09 2.68 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.124 0.488 . . . . 74.41 110.2 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 63.4 -105.51 1.08 Allowed Glycine 0 N--CA 1.449 -0.448 0 CA-C-N 115.638 -0.71 . . . . 71.42 112.843 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . 0.794 ' HG2' ' HB3' ' A' ' 480' ' ' GLU . 18.5 mt-30 -93.1 -25.18 18.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.767 0.318 . . . . 74.42 110.871 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -96.43 153.4 17.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.352 0.596 . . . . 73.25 111.002 -175.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -127.1 123.06 35.98 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.72 -0.673 . . . . 71.33 109.268 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 56.3 m-70 -101.52 118.3 36.67 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.989 -0.374 . . . . 72.1 109.989 -177.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 61.5 tp -104.29 106.69 17.28 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.265 -0.642 . . . . 74.43 109.265 173.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 9.2 tp -104.92 128.77 58.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.992 -0.549 . . . . 75.14 110.133 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.527 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 34.2 mt -104.54 114.3 43.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.204 -0.665 . . . . 61.13 109.204 175.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -58.23 -52.64 64.74 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.547 0.529 . . . . 44.51 111.435 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -137.74 109.64 7.17 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.722 -0.473 . . . . 73.35 109.722 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -76.19 127.38 32.8 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.953 -0.567 . . . . 74.01 111.238 -178.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 518' ' ' MET . . . . . 0.694 ' HA ' ' HE2' ' A' ' 518' ' ' MET . 14.9 mmt -97.51 175.43 6.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.836 -0.62 . . . . 72.35 109.678 176.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.2 -53.36 25.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.952 0.406 . . . . 72.35 110.805 -178.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -71.32 -27.89 63.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.072 -0.513 . . . . 73.11 111.034 -177.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -77.83 -3.44 41.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.516 -0.766 . . . . 72.5 111.857 -173.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.52 ' HA ' HD21 ' A' ' 538' ' ' LEU . . . -74.37 -43.2 57.54 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.498 -0.481 . . . . 62.22 109.918 177.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 38.28 -158.55 0.01 OUTLIER Glycine 0 C--N 1.339 0.734 0 O-C-N 124.457 1.098 . . . . 44.3 115.557 172.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -114.05 108.86 17.57 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.307 -0.627 . . . . 74.22 109.307 169.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . 0.474 ' HE2' HD11 ' A' ' 493' ' ' LEU . 32.1 m-85 -85.63 133.86 34.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.964 0.411 . . . . 73.41 111.087 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -134.35 128.78 34.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.924 -0.58 . . . . 64.44 110.545 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.482 HD11 ' HB ' ' A' ' 484' ' ' VAL . 63.4 tp -99.86 111.98 24.27 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.84 -0.43 . . . . 73.52 109.84 176.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 70.8 m -104.79 126.08 51.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.299 0.571 . . . . 60.01 110.914 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.581 ' C ' ' H ' ' A' ' 531' ' ' GLY . 30.1 p -115.79 -165.52 1.05 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.341 -0.845 . . . . 72.41 110.119 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 530' ' ' SER . . . . . 0.405 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 14.7 m -50.77 7.43 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.859 1.264 . . . . 73.32 114.173 171.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . 0.581 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 122.14 28.18 1.55 Allowed Glycine 0 C--N 1.331 0.266 0 O-C-N 122.007 -0.433 . . . . 62.54 113.245 -174.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -117.76 138.37 13.96 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.603 -1.399 . . . . 51.13 109.603 163.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -129.35 127.92 42.04 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 117.463 0.632 . . . . 73.31 112.103 -171.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -136.62 136.45 39.18 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.485 -0.78 . . . . 74.11 109.551 171.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 33.3 tp -109.09 145.24 36.0 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.817 0.341 . . . . 62.21 111.029 -176.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.723 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -123.72 132.46 53.82 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.092 -0.504 . . . . 72.24 110.324 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -110.41 115.92 30.51 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.77 -0.456 . . . . 71.34 109.77 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.52 HD21 ' HA ' ' A' ' 522' ' ' ALA . 35.7 tp -108.64 121.07 44.25 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.058 -0.519 . . . . 75.11 109.723 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 4.5 mp -109.98 116.64 52.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.228 -0.656 . . . . 73.13 109.228 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.503 HG23 HG23 ' A' ' 465' ' ' VAL . 90.1 t -114.1 128.44 71.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.92 0.391 . . . . 75.23 110.257 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.46 169.65 14.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.048 -0.524 . . . . 64.33 109.894 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.53 141.31 39.67 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.532 -0.758 . . . . 72.32 110.642 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.454 ' HE3' ' HB2' ' A' ' 543' ' ' LYS . 33.2 mtmt . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.398 -0.811 . . . . 72.2 110.033 176.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.448 -1.205 0 N-CA-C 110.391 -0.657 . . . . 73.11 110.391 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.553 ' HB ' ' HB ' ' A' ' 529' ' ' THR . 58.5 t -78.18 107.35 10.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 108.979 -0.749 . . . . 73.04 108.979 178.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 477' ' ' VAL . 62.0 tp -84.91 124.17 31.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.733 -0.667 . . . . 75.0 110.753 -173.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . 0.492 HD12 HD22 ' A' ' 527' ' ' LEU . 29.3 mt -91.01 98.9 8.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.71 -0.677 . . . . 72.42 109.998 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 33.8 p -79.19 -16.04 57.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 72.44 111.088 -176.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . . . . . . . . . 19.2 tpt85 -130.38 102.03 17.21 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.904 -0.589 . . . . 75.14 109.717 177.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.62 167.73 12.89 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 123.224 2.616 . . . . 74.4 112.078 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.78 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 3.2 mm? -71.1 172.59 8.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.077 -0.51 . . . . 73.41 110.906 -177.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . 0.878 ' HG2' ' HA ' ' A' ' 473' ' ' PHE . 13.5 mm-40 -67.78 152.8 45.0 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.787 -0.642 . . . . 72.24 112.488 -176.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -105.53 6.51 32.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.315 -0.857 . . . . 70.43 112.454 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -123.7 154.53 39.29 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.89 0.852 . . . . 71.44 113.008 -162.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.645 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.0 pt? -103.9 146.84 28.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.185 -1.37 . . . . 74.52 111.808 -170.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.529 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 27.5 m -123.71 178.87 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-O 121.079 0.466 . . . . 75.12 111.265 -177.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 10.4 mtm -112.32 161.61 16.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.377 -0.374 . . . . 72.24 111.295 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . 0.45 HG23 ' HG2' ' A' ' 542' ' ' GLU . 59.6 t -56.72 129.67 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 115.955 -0.566 . . . . 52.35 112.178 -176.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 86.12 7.7 79.86 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.72 -0.673 . . . . 75.41 113.208 174.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -116.73 133.01 56.53 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.799 0.299 . . . . 72.41 110.306 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . 0.578 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 5.3 ptm180 -74.02 131.86 41.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.301 0.572 . . . . 72.5 112.1 -175.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.528 ' HB ' HG12 ' A' ' 465' ' ' VAL . 7.5 p -115.37 146.33 19.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.205 -0.907 . . . . 71.55 109.714 176.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -123.03 129.17 51.16 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.381 -0.229 . . . . 75.12 110.381 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.878 ' HA ' ' HG2' ' A' ' 461' ' ' GLU . 96.0 m-85 -106.45 124.89 50.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.437 -0.579 . . . . 74.45 109.437 174.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -100.25 131.48 46.16 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.085 -0.339 . . . . 74.03 110.085 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 18.2 p -141.4 118.05 10.98 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.091 0.472 . . . . 45.42 110.555 177.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.63 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 39.7 mt-10 -107.39 138.58 43.33 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.853 -0.612 . . . . 71.42 109.747 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.434 ' HA ' ' O ' ' A' ' 455' ' ' LEU . 28.2 m -132.57 174.06 13.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.297 -0.411 . . . . 71.12 110.767 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 16.7 p -85.77 8.37 20.2 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.482 0.549 . . . . 74.3 112.482 -175.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . 0.559 ' OE1' ' HA ' ' A' ' 482' ' ' ALA . 41.2 tt0 -126.82 134.83 50.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.6 0.238 . . . . 75.23 110.631 -177.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . 0.51 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 0.4 OUTLIER -81.83 128.27 33.85 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.555 -0.535 . . . . 73.23 109.555 179.15 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 60.27 32.79 77.89 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.165 -1.017 . . . . 62.55 110.879 -171.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.559 ' HA ' ' OE1' ' A' ' 479' ' ' GLU . . . -50.71 141.67 12.5 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 113.145 0.794 . . . . 75.51 113.145 -174.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -74.79 103.7 5.14 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.126 -0.943 . . . . 75.5 109.813 175.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.511 ' HB ' HD11 ' A' ' 527' ' ' LEU . 34.3 m -121.51 150.11 24.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.931 -0.577 . . . . 73.22 110.836 -177.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 47.1 tttp -123.27 126.86 47.7 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.213 -0.662 . . . . 73.21 109.213 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . 0.458 ' HB3' HD13 ' A' ' 493' ' ' LEU . 95.3 m95 -101.39 125.29 48.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.605 -0.27 . . . . 74.35 110.638 -177.475 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . 0.424 HD11 ' SG ' ' A' ' 528' ' ' CYS . 6.5 mp -128.12 144.07 51.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.065 0.459 . . . . 75.41 110.77 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.467 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 5.8 tmmm? -124.19 106.78 10.58 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.363 -0.977 . . . . 74.13 108.363 174.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 52.21 36.01 18.23 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.749 0.656 . . . . 73.24 111.693 -175.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.02 -20.07 51.73 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.869 -0.681 . . . . 64.33 112.921 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 43.4 t -86.64 123.79 39.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 110.092 -0.336 . . . . 63.44 110.092 -179.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -70.6 134.28 47.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.094 0.473 . . . . 74.41 110.804 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.458 HD13 ' HB3' ' A' ' 486' ' ' TRP . 52.2 mt -82.73 103.22 12.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.767 -0.651 . . . . 75.53 109.411 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 7.0 t -65.15 145.52 56.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 73.1 111.631 -177.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.62 9.5 17.88 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.149 -0.932 . . . . 75.15 109.482 176.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.32 -44.41 16.24 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.723 -0.671 . . . . 74.54 110.04 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' A' ' 497' ' ' GLU . 7.0 pt-20 -143.16 110.08 5.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.314 0.578 . . . . 73.33 109.573 171.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' THR . . . . . 0.515 HG23 ' HB2' ' A' ' 501' ' ' TYR . 0.3 OUTLIER -142.76 109.54 5.47 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.231 0.539 . . . . 71.25 111.381 -177.072 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -89.88 -7.54 53.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.616 -0.72 . . . . 72.23 110.871 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . 0.416 ' CG ' ' HB2' ' A' ' 516' ' ' GLU . 3.4 mtmm -114.4 -48.75 2.86 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.048 -0.524 . . . . 64.44 112.054 -173.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.515 ' HB2' HG23 ' A' ' 498' ' ' THR . 57.2 m-85 -93.04 126.77 38.29 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.813 -0.44 . . . . 75.5 109.813 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 502' ' ' ARG . . . . . 0.439 ' HD2' ' HA ' ' A' ' 502' ' ' ARG . 1.2 tpt180 -117.09 123.11 45.99 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.234 -0.654 . . . . 74.43 109.234 177.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -104.13 117.46 34.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.236 -0.438 . . . . 71.12 110.228 -174.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 57.2 mttm -114.35 131.56 56.51 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.35 -0.386 . . . . 73.11 110.576 -178.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -103.9 118.27 36.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.196 -0.456 . . . . 73.14 110.687 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -120.42 89.92 3.22 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.104 -0.498 . . . . 64.52 110.016 174.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 61.68 -101.45 0.35 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.637 -0.71 . . . . 74.52 112.518 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . 0.51 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 26.5 mt-30 -98.88 -20.23 16.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.524 0.202 . . . . 75.44 111.376 -177.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.63 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 14.7 ptt180 -101.04 153.54 19.46 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.333 0.587 . . . . 73.45 111.585 -175.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -121.99 141.37 51.41 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.424 -0.807 . . . . 75.53 109.494 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 15.3 m-70 -110.6 133.26 53.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 110.02 -0.363 . . . . 75.43 110.02 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.517 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 66.6 tp -107.51 104.19 13.69 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.739 -0.467 . . . . 64.32 109.739 172.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.478 HD12 ' HD2' ' A' ' 504' ' ' LYS . 1.9 mp -100.91 127.7 53.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.065 -0.516 . . . . 53.33 110.092 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.578 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 53.7 mt -108.1 112.37 39.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.743 -0.466 . . . . 73.33 109.743 174.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -72.44 -44.45 62.37 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.195 -0.457 . . . . 71.32 111.144 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . 0.416 ' HB2' ' CG ' ' A' ' 500' ' ' LYS . 31.8 mt-10 -116.2 107.52 14.99 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.591 -0.522 . . . . 60.33 109.591 -178.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . 0.403 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -94.2 113.21 25.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.383 -0.371 . . . . 62.23 110.47 -179.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 518' ' ' MET . . . . . 0.42 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 25.0 mmt -110.7 164.8 12.39 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.166 -0.47 . . . . 62.44 110.281 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . 0.505 HD12 ' HG3' ' A' ' 542' ' ' GLU . 3.1 mm? -61.37 -55.41 31.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 72.05 111.529 -172.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -82.99 -8.04 59.6 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.104 -0.498 . . . . 74.24 111.528 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 9.2 t70 -82.28 -27.26 32.48 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.312 -0.404 . . . . 70.11 110.521 -175.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.471 ' HB2' HG22 ' A' ' 540' ' ' VAL . . . -63.27 -41.73 99.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 73.4 111.614 -177.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . 0.467 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 42.48 -158.2 0.07 OUTLIER Glycine 0 CA--C 1.526 0.742 0 O-C-N 123.783 0.677 . . . . 51.3 114.422 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -109.6 115.69 30.36 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.007 -0.738 . . . . 65.14 109.007 172.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -89.48 131.67 35.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.349 0.595 . . . . 73.35 111.145 -176.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.94 125.48 33.55 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.434 -0.803 . . . . 75.42 110.186 178.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.511 HD11 ' HB ' ' A' ' 484' ' ' VAL . 44.6 tp -92.55 112.32 24.23 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.478 -0.564 . . . . 74.24 109.478 177.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . 0.424 ' SG ' HD11 ' A' ' 487' ' ' LEU . 62.2 m -107.42 114.89 29.2 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.882 -0.599 . . . . 75.31 110.321 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.601 ' C ' ' H ' ' A' ' 531' ' ' GLY . 72.2 p -109.89 -165.39 1.0 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.054 -0.521 . . . . 74.01 109.874 178.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 530' ' ' SER . . . . . 0.437 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 20.3 m -48.6 6.65 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.742 1.217 . . . . 72.12 114.18 171.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . 0.601 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.44 26.62 1.95 Allowed Glycine 0 N--CA 1.451 -0.356 0 O-C-N 122.092 -0.38 . . . . 63.2 112.949 -176.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -110.45 144.38 17.08 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 109.406 -1.477 . . . . 72.43 109.406 163.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.58 132.39 48.21 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 117.83 0.815 . . . . 73.15 111.613 -171.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -141.12 128.59 21.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.697 -0.683 . . . . 62.35 109.451 172.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.426 HD12 ' N ' ' A' ' 536' ' ' ALA . 2.7 tm? -114.8 131.95 56.64 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 110.101 -0.333 . . . . 71.1 110.101 -174.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.78 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -128.95 158.17 39.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.53 -0.305 . . . . 71.04 110.583 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -131.9 117.49 18.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.533 -0.303 . . . . 72.13 110.19 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.464 HD13 HG22 ' A' ' 465' ' ' VAL . 37.3 tp -106.1 128.71 54.07 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.979 -0.555 . . . . 74.2 109.831 178.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.645 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.3 mp -117.89 108.7 25.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 109.365 -0.605 . . . . 71.44 109.365 177.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 465' ' ' VAL . 66.9 t -90.64 132.37 35.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.784 -0.45 . . . . 72.02 109.784 178.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -120.89 157.9 28.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.815 -0.63 . . . . 73.23 110.333 -175.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . 0.505 ' HG3' HD12 ' A' ' 519' ' ' LEU . 39.0 mt-10 -107.9 117.77 35.0 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.967 -0.561 . . . . 64.32 110.38 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.871 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 9.6 mmpt? . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.31 -0.852 . . . . 75.42 109.58 171.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo . . . . . 0 N--CA 1.456 -0.721 0 N-CA-C 111.136 -0.371 . . . . 71.23 111.136 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.469 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 83.0 t -67.08 111.51 2.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.064 0.459 . . . . 71.1 110.065 178.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 60.1 tp -91.22 148.63 22.22 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.498 -0.773 . . . . 62.4 110.344 -176.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . 0.516 HD11 HD21 ' A' ' 527' ' ' LEU . 25.2 mt -94.79 99.52 9.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.232 -0.655 . . . . 74.32 109.232 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 12.5 p -70.02 -34.51 73.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.006 -0.543 . . . . 73.33 110.904 -176.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -116.77 105.52 49.6 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 116.03 -0.532 . . . . 72.24 109.937 174.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -66.55 168.86 15.45 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.193 2.595 . . . . 74.12 111.254 175.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.638 ' HB2' ' HB1' ' A' ' 536' ' ' ALA . 2.5 mm? -65.0 153.59 40.22 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.811 -0.44 . . . . 72.3 109.811 -178.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -66.37 152.99 43.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.412 0.625 . . . . 73.1 111.652 -170.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -92.02 9.01 35.03 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.816 1.043 . . . . 73.31 113.816 -167.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.13 153.86 39.41 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.572 -0.851 . . . . 75.22 112.109 -166.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.469 ' CD1' ' HB ' ' A' ' 539' ' ' ILE . 2.3 pt? -118.02 144.9 45.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.291 -1.322 . . . . 72.44 110.798 -170.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.402 HG12 ' HB ' ' A' ' 471' ' ' VAL . 31.2 m -117.71 177.64 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.225 0.536 . . . . 74.11 112.131 -174.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' MET . . . . . 0.485 ' HE3' ' N ' ' A' ' 466' ' ' MET . 0.0 OUTLIER -93.81 171.12 9.07 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.543 -0.753 . . . . 75.54 110.707 179.814 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . 0.505 HG23 ' HG2' ' A' ' 542' ' ' GLU . 46.8 t -59.67 125.81 16.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.211 -0.449 . . . . 51.11 111.32 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 81.96 3.4 90.59 Favored Glycine 0 CA--C 1.517 0.201 0 CA-C-N 115.889 -0.596 . . . . 63.1 113.065 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -96.01 136.99 35.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.752 0.311 . . . . 74.14 110.608 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . 0.476 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 1.5 ptm180 -66.84 146.69 54.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.824 -0.625 . . . . 74.32 111.377 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.402 ' HB ' HG12 ' A' ' 465' ' ' VAL . 7.7 p -147.38 137.94 17.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.579 -0.737 . . . . 73.23 109.643 175.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.517 ' HG3' HG13 ' A' ' 513' ' ' ILE . 13.0 mp0 -107.68 130.96 54.88 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.871 0.367 . . . . 73.15 110.559 178.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.561 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 57.8 m-85 -108.07 113.21 26.2 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.574 -0.528 . . . . 72.33 109.574 170.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -95.81 132.45 41.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.649 -0.705 . . . . 75.13 110.388 -176.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 7.0 p -141.29 118.54 11.38 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.875 0.369 . . . . 73.2 110.613 177.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.975 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 23.4 mt-10 -112.16 138.24 49.12 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.527 -0.545 . . . . 75.42 109.527 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.469 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 26.2 m -122.6 173.12 8.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.578 -0.283 . . . . 71.21 111.304 -178.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 15.4 m -61.61 -36.27 80.26 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.152 0.797 . . . . 73.35 113.152 -175.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -119.72 156.25 30.89 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.421 -0.215 . . . . 72.1 110.421 -172.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . 0.467 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 0.1 OUTLIER -86.34 143.72 27.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.095 0.474 . . . . 73.22 110.563 -179.005 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 72.62 3.38 58.57 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.821 -0.704 . . . . 71.33 112.733 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.459 ' HB2' HG21 ' A' ' 477' ' ' VAL . . . -56.07 134.38 52.59 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.845 0.355 . . . . 74.22 110.959 -179.048 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -78.09 139.3 39.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.748 -0.66 . . . . 74.23 110.058 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.546 ' HB ' HD11 ' A' ' 527' ' ' LEU . 20.1 m -127.44 150.58 33.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.049 0.452 . . . . 72.3 110.875 -178.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . 0.529 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 65.4 tttp -108.2 122.09 46.2 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.608 -0.724 . . . . 73.32 109.378 179.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . 0.521 ' HB3' HD11 ' A' ' 493' ' ' LEU . 59.1 m95 -101.34 122.22 43.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.945 0.403 . . . . 75.32 110.623 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . 0.423 HD11 ' HE3' ' A' ' 485' ' ' LYS . 86.0 mt -130.15 139.08 50.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.865 -0.607 . . . . 63.04 111.34 -176.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.62 ' O ' HG13 ' A' ' 491' ' ' VAL . 3.7 tmmm? -115.3 106.52 14.13 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.085 -1.08 . . . . 73.31 108.085 168.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 51.79 34.37 13.06 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.162 -0.472 . . . . 70.33 111.253 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.42 -14.57 60.78 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.807 -0.711 . . . . 51.21 114.015 175.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . 0.62 HG13 ' O ' ' A' ' 488' ' ' LYS . 6.2 p -87.89 139.72 16.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-N 117.862 0.831 . . . . 51.03 110.559 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -66.59 124.18 22.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.986 -0.552 . . . . 75.2 111.567 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.521 HD11 ' HB3' ' A' ' 486' ' ' TRP . 94.1 mt -84.15 106.81 16.08 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.921 -0.77 . . . . 73.35 108.921 171.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 5.5 t -64.39 129.09 38.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.331 0.586 . . . . 74.43 111.656 -174.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.16 3.01 18.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.587 -0.733 . . . . 74.01 110.455 176.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -59.6 -54.27 48.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.099 -0.5 . . . . 72.14 109.954 173.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -149.34 111.62 4.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.609 -0.723 . . . . 74.35 109.833 174.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.2 OUTLIER -124.6 125.83 44.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.061 -0.518 . . . . 72.44 110.229 -178.119 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -94.81 -42.08 8.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.452 0.644 . . . . 74.35 110.17 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . 0.419 ' HZ2' ' CG ' ' A' ' 521' ' ' ASP . 33.8 mtmt -80.17 -44.25 20.17 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.318 -0.856 . . . . 71.13 110.895 -173.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.444 ' O ' ' HB ' ' A' ' 498' ' ' THR . 5.1 m-85 -104.95 141.82 35.88 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.027 -0.731 . . . . 74.1 109.027 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 502' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 502' ' ' ARG . 21.0 mtp180 -128.26 123.22 33.59 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.111 0.481 . . . . 65.42 109.742 176.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -94.77 127.8 41.03 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.634 -0.712 . . . . 74.32 110.368 -174.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.595 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 1.3 mptm? -114.4 144.85 42.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.421 -0.354 . . . . 73.25 110.679 177.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -116.24 130.35 56.74 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.051 -0.522 . . . . 72.34 109.823 177.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -138.83 86.83 2.17 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.136 0.493 . . . . 75.2 110.06 175.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 63.7 -104.28 0.83 Allowed Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.899 -0.591 . . . . 71.54 112.551 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . 0.467 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 21.6 mt-30 -95.43 -15.36 23.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.865 0.365 . . . . 73.51 110.797 -176.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.975 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 5.7 ptt180 -106.93 139.58 41.1 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.507 0.67 . . . . 73.53 111.786 -175.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -114.5 143.85 44.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.179 -0.919 . . . . 72.23 108.71 176.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . 0.595 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 84.6 m-70 -118.14 128.0 54.31 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.339 -0.245 . . . . 74.24 110.339 -177.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.561 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 57.7 tp -104.16 103.86 13.7 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.793 -0.447 . . . . 75.24 109.793 174.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.517 HG13 ' HG3' ' A' ' 472' ' ' GLU . 1.7 mp -98.23 118.93 45.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.025 -0.534 . . . . 74.23 110.217 177.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.476 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 62.2 mt -100.17 113.2 34.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.813 -0.63 . . . . 62.14 109.659 175.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -75.47 -46.98 29.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.102 0.477 . . . . 71.51 110.611 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -121.17 108.33 13.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.727 -0.67 . . . . 71.2 109.629 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . 0.452 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -91.37 117.34 29.58 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.156 -0.475 . . . . 74.14 110.302 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 25.7 mmt -108.14 166.85 10.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.448 -0.342 . . . . 73.41 110.548 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.73 -53.32 59.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 45.3 111.214 -174.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -77.69 -18.04 57.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.818 -0.628 . . . . 72.42 110.975 -175.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . 0.419 ' CG ' ' HZ2' ' A' ' 500' ' ' LYS . 83.9 m-20 -80.17 -21.02 43.49 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.106 -0.497 . . . . 71.11 111.831 -174.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.511 ' HA ' HD22 ' A' ' 538' ' ' LEU . . . -63.36 -42.85 98.91 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.966 -0.293 . . . . 72.33 110.892 -177.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.23 -158.66 0.06 OUTLIER Glycine 0 C--N 1.335 0.498 0 CA-C-N 115.282 -0.872 . . . . 54.24 114.02 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 -118.98 108.64 15.0 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.087 -0.709 . . . . 75.41 109.087 170.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . 0.45 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 16.1 m-30 -85.19 132.81 34.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.084 -0.507 . . . . 74.5 111.186 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -134.89 119.25 17.84 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.539 -0.755 . . . . 64.41 109.641 176.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.546 HD11 ' HB ' ' A' ' 484' ' ' VAL . 40.9 tp -89.02 117.95 28.4 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.244 -0.434 . . . . 73.41 110.171 -177.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 70.0 m -104.45 122.88 46.45 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.975 -0.557 . . . . 72.4 109.976 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.581 ' C ' ' H ' ' A' ' 531' ' ' GLY . 0.2 OUTLIER -116.54 -167.08 1.23 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.889 -0.596 . . . . 74.32 110.275 -175.724 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 530' ' ' SER . . . . . 0.432 ' H ' HG22 ' A' ' 529' ' ' THR . 9.9 m -52.11 7.4 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.418 1.487 . . . . 62.12 114.082 173.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . 0.581 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.14 26.73 1.99 Allowed Glycine 0 N--CA 1.452 -0.293 0 N-CA-C 111.69 -0.564 . . . . 73.12 111.69 -168.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -123.75 142.29 14.17 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 109.168 -1.573 . . . . 71.44 109.168 165.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.29 121.36 20.03 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 117.701 0.751 . . . . 73.21 110.694 -173.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -118.28 139.08 51.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.174 -0.466 . . . . 72.25 110.745 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.402 HD12 ' N ' ' A' ' 536' ' ' ALA . 3.0 tm? -106.61 134.96 48.96 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.568 -0.53 . . . . 74.52 109.568 -177.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.638 ' HB1' ' HB2' ' A' ' 460' ' ' LEU . . . -118.47 152.58 35.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.771 0.32 . . . . 55.51 111.242 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -117.19 116.18 26.77 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.119 -0.492 . . . . 74.34 109.901 175.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.511 HD22 ' HA ' ' A' ' 522' ' ' ALA . 28.1 tp -129.82 115.9 17.92 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.989 0.424 . . . . 72.34 109.878 175.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.469 ' HB ' ' CD1' ' A' ' 464' ' ' LEU . 62.0 mt -126.95 109.05 19.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.333 -0.617 . . . . 73.43 109.333 176.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.487 HG23 ' HB1' ' A' ' 522' ' ' ALA . 79.2 t -89.67 127.83 42.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 N-CA-C 109.284 -0.636 . . . . 50.34 109.284 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -126.65 144.3 50.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.848 -0.615 . . . . 73.25 110.855 -174.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . 0.505 ' HG2' HG23 ' A' ' 467' ' ' VAL . 37.7 mt-10 -89.2 109.95 20.76 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.115 -0.698 . . . . 72.54 109.115 173.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 58.1 pttt . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.539 -0.743 . . . . 73.02 109.961 -178.433 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.448 -1.165 0 N-CA-C 110.214 -0.725 . . . . 72.11 110.214 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.451 ' H ' ' HB2' ' A' ' 530' ' ' SER . 98.2 t -74.86 110.27 9.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.817 -0.438 . . . . 71.35 109.817 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 60.4 tp -79.49 129.95 34.95 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.624 -0.716 . . . . 71.22 110.151 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . 0.468 HD11 HD21 ' A' ' 527' ' ' LEU . 42.3 mt -80.27 98.23 3.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.884 -0.784 . . . . 70.02 108.884 175.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 35.7 p -69.62 -39.45 77.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.627 -0.715 . . . . 71.04 111.382 -172.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.667 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 6.4 tpt180 -102.81 122.46 45.75 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.843 -0.617 . . . . 74.01 110.5 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.43 165.72 23.98 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.87 2.38 . . . . 73.35 112.294 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.522 ' CB ' ' HB3' ' A' ' 536' ' ' ALA . 4.1 mm? -80.26 172.01 14.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.129 -0.487 . . . . 75.31 111.408 -179.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . 0.54 ' HG3' ' OE1' ' A' ' 463' ' ' GLN . 0.3 OUTLIER -69.3 138.31 53.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.495 -0.775 . . . . 74.2 111.561 -175.64 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -104.97 8.56 34.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.983 -1.008 . . . . 70.34 113.321 -169.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . 0.54 ' OE1' ' HG3' ' A' ' 461' ' ' GLU . 0.2 OUTLIER -124.07 152.73 42.34 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 119.54 -0.864 . . . . 72.11 112.151 -168.709 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.578 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.3 pt? -100.4 146.43 27.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.495 -1.23 . . . . 73.52 111.433 -171.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.468 HG12 ' HB ' ' A' ' 471' ' ' VAL . 27.1 m -117.82 177.09 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.04 0.447 . . . . 71.34 110.508 175.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' MET . . . . . 0.408 ' HG2' ' HG3' ' A' ' 543' ' ' LYS . 37.7 mtm -118.18 159.77 22.73 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.001 -0.545 . . . . 74.55 110.135 -177.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . 0.481 HG22 ' HG2' ' A' ' 542' ' ' GLU . 64.8 t -55.27 124.33 8.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.004 0.43 . . . . 72.41 111.495 -174.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.41 -11.96 58.31 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.975 -0.631 . . . . 54.44 112.616 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -102.98 145.3 30.08 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.102 -0.333 . . . . 73.54 110.102 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . 0.495 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 5.4 ptp180 -86.76 135.1 33.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.268 0.556 . . . . 73.24 111.649 -177.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.468 ' HB ' HG12 ' A' ' 465' ' ' VAL . 7.1 p -119.1 133.96 64.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.622 -0.717 . . . . 73.2 110.019 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -115.44 127.9 55.66 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.507 -0.315 . . . . 64.11 110.176 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.442 ' HB3' HD12 ' A' ' 460' ' ' LEU . 96.5 m-85 -104.77 115.65 30.67 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.479 -0.563 . . . . 74.14 109.479 177.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.42 133.96 47.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.234 -0.439 . . . . 72.14 110.046 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 509' ' ' ARG . 20.9 p -149.41 147.56 28.42 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.194 -0.457 . . . . 74.43 110.681 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.667 ' HB2' ' HB3' ' A' ' 458' ' ' ARG . 49.1 mt-10 -123.07 138.75 54.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.839 0.352 . . . . 65.13 110.286 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 18.6 m -113.11 163.3 10.44 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.928 -0.578 . . . . 74.24 109.742 174.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 11.5 t -60.67 -38.35 84.63 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.162 0.43 . . . . 72.35 112.162 -175.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . 0.515 ' HB3' ' HB1' ' A' ' 482' ' ' ALA . 6.6 tp10 -106.98 139.71 40.94 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.255 -0.276 . . . . 75.24 110.255 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.51 134.98 43.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.261 0.553 . . . . 73.12 111.157 -177.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 63.46 19.74 62.66 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.749 -0.66 . . . . 74.31 112.862 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.515 ' HB1' ' HB3' ' A' ' 479' ' ' GLU . . . -62.1 151.56 35.3 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.93 0.395 . . . . 74.21 111.077 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.54 118.89 16.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.451 0.643 . . . . 75.14 110.912 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.53 ' HB ' HD12 ' A' ' 527' ' ' LEU . 34.9 m -127.34 150.66 33.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.299 -0.864 . . . . 74.11 109.508 178.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . 0.54 ' HE2' ' HG3' ' A' ' 492' ' ' GLU . 83.6 tttt -128.31 136.33 50.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.768 0.318 . . . . 72.23 110.18 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . 0.529 ' HB3' HD11 ' A' ' 493' ' ' LEU . 90.1 m95 -102.15 125.92 48.97 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.971 0.415 . . . . 72.12 110.814 -176.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . 0.52 ' HG ' ' HA ' ' A' ' 492' ' ' GLU . 8.0 mp -126.32 159.53 32.88 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.926 -0.579 . . . . 61.41 110.068 176.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -141.15 116.97 10.39 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.448 -0.575 . . . . 74.33 109.448 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 57.82 34.14 24.04 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.511 0.507 . . . . 65.24 110.614 -175.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 81.98 -10.71 51.67 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.683 -0.689 . . . . 74.0 112.449 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 40.6 t -86.78 129.98 37.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.869 -0.419 . . . . 74.04 109.869 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . 0.54 ' HG3' ' HE2' ' A' ' 485' ' ' LYS . 33.1 tt0 -65.27 131.07 45.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.67 . . . . 74.31 110.259 -179.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.529 HD11 ' HB3' ' A' ' 486' ' ' TRP . 85.6 mt -85.54 118.24 24.93 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.945 -0.391 . . . . 74.31 109.945 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 5.1 t -67.18 145.85 54.82 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.571 -0.741 . . . . 75.1 111.161 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.44 16.09 12.12 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.14 -0.689 . . . . 75.42 109.14 175.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -76.98 -60.97 2.14 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.231 -0.895 . . . . 71.32 109.578 176.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 497' ' ' GLU . 0.8 OUTLIER -105.31 106.56 17.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.286 0.565 . . . . 74.24 109.899 174.595 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' THR . . . . . 0.471 HG22 ' HE1' ' A' ' 503' ' ' PHE . 2.8 p -136.73 87.62 2.3 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.392 0.615 . . . . 73.03 111.505 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -105.8 -26.69 11.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.597 -0.729 . . . . 72.54 109.339 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . 0.432 ' HE3' ' CE2' ' A' ' 501' ' ' TYR . 42.2 pttt -94.51 -22.83 17.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.262 -0.881 . . . . 71.52 110.831 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.469 ' O ' ' HB ' ' A' ' 498' ' ' THR . 6.6 m-85 -118.88 133.67 55.68 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.703 -0.48 . . . . 54.41 109.703 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 502' ' ' ARG . . . . . 0.613 ' HB2' ' CG2' ' A' ' 513' ' ' ILE . 33.7 mmt180 -122.99 126.79 47.83 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.902 -0.407 . . . . 74.44 109.902 176.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . 0.471 ' HE1' HG22 ' A' ' 498' ' ' THR . 88.7 m-85 -94.98 113.26 24.95 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.063 -0.347 . . . . 75.22 110.063 178.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 4.7 mptp? -102.08 119.89 39.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.608 -0.269 . . . . 72.32 111.047 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -102.62 111.91 24.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.261 -0.644 . . . . 73.54 109.261 173.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 509' ' ' ARG . 33.1 t70 -136.28 74.6 1.51 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.299 0.571 . . . . 74.25 110.137 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 82.58 -131.71 10.58 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.804 -0.712 . . . . 51.3 112.055 -178.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -79.23 -23.63 43.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.066 0.46 . . . . 60.31 110.397 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 506' ' ' ASP . 18.4 ptt180 -89.48 143.32 26.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.501 -0.772 . . . . 73.11 110.805 -177.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 -130.26 118.96 22.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.826 -0.624 . . . . 71.13 109.492 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 13.5 m-70 -101.87 122.84 44.76 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.993 -0.283 . . . . 74.01 110.349 -176.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 67.8 tp -105.75 108.51 20.06 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.556 -0.535 . . . . 75.23 109.556 172.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.613 ' CG2' ' HB2' ' A' ' 502' ' ' ARG . 9.8 tp -99.47 124.72 52.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.323 0.582 . . . . 74.11 110.328 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 74.5 mt -104.29 111.7 34.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 108.93 -0.767 . . . . 72.41 108.93 173.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -72.92 -44.04 61.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.132 0.491 . . . . 73.23 110.829 -176.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -131.24 108.85 9.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.815 -0.629 . . . . 75.5 109.885 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . 0.404 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -90.52 131.37 36.3 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.191 -0.459 . . . . 73.22 110.768 -178.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 518' ' ' MET . . . . . 0.808 ' HA ' ' HE3' ' A' ' 518' ' ' MET . 10.1 mmt -95.69 167.25 11.4 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.225 -0.443 . . . . 74.01 110.502 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . 0.445 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.7 mm? -62.39 -53.73 50.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.88 0.371 . . . . 74.43 111.593 -176.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -81.57 -12.15 58.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.114 0.483 . . . . 74.35 110.669 -177.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . 0.49 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 29.1 t70 -74.93 -16.41 60.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.713 -0.676 . . . . 74.2 111.057 -175.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.526 ' HB1' ' O ' ' A' ' 538' ' ' LEU . . . -61.42 -41.77 97.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.644 -0.253 . . . . 74.42 110.409 -178.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 40.0 -157.23 0.03 OUTLIER Glycine 0 CA--C 1.522 0.53 0 N-CA-C 116.0 1.16 . . . . 72.5 116.0 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -118.49 107.24 13.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.57 -0.815 . . . . 63.51 109.056 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -85.94 133.55 33.93 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.069 0.461 . . . . 64.33 111.283 -176.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -135.56 137.75 42.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.769 -0.65 . . . . 72.03 110.558 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.53 HD12 ' HB ' ' A' ' 484' ' ' VAL . 42.1 tp -102.87 110.09 21.89 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.054 -0.521 . . . . 64.24 110.172 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . 0.413 ' SG ' HD13 ' A' ' 487' ' ' LEU . 94.6 m -90.76 117.09 29.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.147 -0.478 . . . . 74.14 110.189 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.558 ' C ' ' H ' ' A' ' 531' ' ' GLY . 0.2 OUTLIER -115.82 -169.86 1.67 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.88 -0.6 . . . . 44.33 110.275 -177.711 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 530' ' ' SER . . . . . 0.451 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 17.3 m -55.57 8.96 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.12 1.368 . . . . 75.34 113.772 173.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . 0.558 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.76 26.88 2.03 Favored Glycine 0 N--CA 1.45 -0.405 0 CA-C-O 121.515 0.508 . . . . 71.12 111.942 -170.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -115.04 144.47 18.45 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 109.608 -1.397 . . . . 71.5 109.608 165.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -132.7 120.74 22.1 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 117.586 0.693 . . . . 72.44 111.405 -174.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -127.44 147.1 50.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.658 -0.701 . . . . 74.01 109.658 173.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.498 HD11 ' N ' ' A' ' 536' ' ' ALA . 2.0 tm? -123.43 137.76 54.74 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.879 -0.415 . . . . 44.11 109.879 -176.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.522 ' HB3' ' CB ' ' A' ' 460' ' ' LEU . . . -132.51 141.05 48.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.439 -0.346 . . . . 71.41 110.324 177.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -121.47 117.21 26.28 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.233 0.539 . . . . 65.34 110.978 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.526 ' O ' ' HB1' ' A' ' 522' ' ' ALA . 46.9 tp -102.01 140.47 36.25 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.284 -0.871 . . . . 73.41 109.162 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.578 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 5.0 mp -125.28 108.62 20.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.536 -0.542 . . . . 71.42 109.536 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.404 HG23 ' HB2' ' A' ' 517' ' ' ALA . 66.7 t -107.13 129.3 61.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.921 0.391 . . . . 74.21 110.647 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.51 150.95 50.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.833 -0.622 . . . . 63.12 109.529 178.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . 0.481 ' HG2' HG22 ' A' ' 467' ' ' VAL . 34.3 mt-10 -73.93 108.75 6.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.059 0.457 . . . . 75.21 110.407 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.484 ' HA ' ' HZ1' ' A' ' 543' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 N-CA-C 108.889 -0.782 . . . . 72.45 108.889 179.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo . . . . . 0 N--CA 1.454 -0.816 0 N-CA-C 111.205 -0.344 . . . . 65.22 111.205 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.43 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 94.7 t -76.2 107.69 7.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 109.485 -0.561 . . . . 75.2 109.485 178.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 54.6 tp -98.43 133.42 42.84 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.67 -0.695 . . . . 70.52 110.142 -176.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 54.2 mt -74.04 102.84 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 109.242 -0.651 . . . . 74.43 109.242 178.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.25 -13.19 57.42 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.415 -0.812 . . . . 51.52 110.657 -173.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.402 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 18.8 tpp180 -137.95 112.04 8.82 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 116.001 -0.545 . . . . 74.52 109.764 175.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -57.19 166.2 4.57 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.786 2.324 . . . . 70.12 111.669 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.698 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 1.7 mm? -74.3 171.75 13.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.385 -0.371 . . . . 71.34 110.474 -175.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -66.67 148.25 52.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.868 -0.606 . . . . 73.41 111.805 -171.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -105.35 9.94 33.63 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.768 1.025 . . . . 73.22 113.768 -169.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.92 153.18 38.81 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 119.063 -1.055 . . . . 75.35 112.592 -165.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 1.9 pt? -94.18 146.9 23.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.008 -1.451 . . . . 73.41 111.353 -173.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.583 HG23 HG22 ' A' ' 540' ' ' VAL . 29.7 m -128.34 177.2 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 73.1 111.682 -175.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' MET . . . . . 0.577 ' HE1' ' HE3' ' A' ' 543' ' ' LYS . 2.0 mpt? -109.31 165.82 11.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 75.05 110.276 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . 0.413 HG13 ' HA ' ' A' ' 518' ' ' MET . 13.9 m -68.08 139.56 20.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.003 0.43 . . . . 62.55 111.263 177.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 78.61 4.03 87.31 Favored Glycine 0 CA--C 1.518 0.268 0 CA-C-N 115.899 -0.591 . . . . 62.35 113.452 175.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -108.21 143.85 36.46 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.848 -0.427 . . . . 74.34 109.848 178.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . 0.586 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 0.0 OUTLIER -66.42 140.4 58.05 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.18 0.514 . . . . 63.24 110.997 -179.134 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.446 ' HB ' ' HB ' ' A' ' 514' ' ' ILE . 4.6 t -114.52 133.37 60.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.712 -0.676 . . . . 64.5 109.654 177.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -112.37 119.47 38.37 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.054 0.454 . . . . 75.04 110.467 178.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.461 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 36.6 m-85 -109.46 130.58 55.49 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.524 -0.762 . . . . 71.2 110.635 174.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -109.65 140.55 43.35 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.016 -0.538 . . . . 72.0 110.149 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.625 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 21.9 p -149.47 125.46 10.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.788 0.328 . . . . 74.25 110.872 177.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.402 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 44.8 mt-10 -108.56 140.92 41.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.15 -0.477 . . . . 75.54 109.739 178.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.43 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 27.9 m -130.24 170.6 18.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.61 0.243 . . . . 75.53 110.658 176.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 12.5 p -70.6 -35.3 72.93 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.514 0.561 . . . . 74.1 112.514 -174.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . 0.527 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 39.6 tt0 -101.96 134.14 45.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.72 0.295 . . . . 72.2 110.93 -178.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . 0.585 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 14.0 pt-20 -79.23 132.26 36.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.954 0.407 . . . . 74.44 110.059 176.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . 0.536 ' HA2' ' HD2' ' A' ' 505' ' ' LYS . . . 75.93 12.01 84.28 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.783 -0.723 . . . . 74.11 112.437 -176.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.527 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -60.37 141.58 56.09 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.781 0.324 . . . . 74.31 111.477 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . 0.405 ' O ' ' HG2' ' A' ' 483' ' ' GLN . 0.0 OUTLIER -83.69 118.03 23.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.321 0.581 . . . . 72.23 110.558 -178.415 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 26.3 m -136.12 159.69 38.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.656 -0.702 . . . . 75.52 110.222 -178.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 66.0 pttt -136.0 152.94 51.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.806 0.336 . . . . 71.34 110.497 176.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -102.78 134.0 46.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.094 -0.503 . . . . 73.32 111.359 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . 0.543 HD13 ' SG ' ' A' ' 528' ' ' CYS . 10.7 mp -118.33 136.28 53.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.699 -0.682 . . . . 73.23 109.205 172.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.455 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 3.0 tmmm? -120.66 110.33 16.28 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.878 0.37 . . . . 73.2 110.077 -177.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.5 t70 58.04 35.66 25.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.182 -0.917 . . . . 74.32 110.591 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 92.79 -9.23 75.89 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.673 -0.694 . . . . 61.35 112.88 178.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 46.9 t -101.42 122.95 54.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 110.189 -0.3 . . . . 71.44 110.189 -179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . 0.529 ' HA ' ' HG ' ' A' ' 487' ' ' LEU . 36.0 tt0 -70.99 127.82 33.87 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.097 -0.501 . . . . 74.31 110.232 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.655 HD11 ' HE1' ' A' ' 525' ' ' TYR . 91.7 mt -77.53 119.82 21.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.269 -0.423 . . . . 74.5 110.24 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 15.0 t -71.64 144.51 49.39 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.184 0.516 . . . . 74.1 110.234 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . 0.5 ' N ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -113.98 10.3 17.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.052 -0.522 . . . . 75.12 109.983 -179.387 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -79.4 -36.2 39.49 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.112 -0.699 . . . . 75.44 109.112 175.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.77 133.79 47.2 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.809 -0.812 . . . . 74.33 108.809 172.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' THR . . . . . 0.507 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.3 OUTLIER -151.17 88.72 1.47 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.348 0.594 . . . . 62.25 111.164 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -101.92 -23.66 14.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.494 -0.775 . . . . 74.31 109.289 176.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -92.61 -22.63 19.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.505 -0.77 . . . . 75.12 110.406 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.507 ' O ' ' HB ' ' A' ' 498' ' ' THR . 27.7 m-85 -128.97 161.05 30.81 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.402 -0.363 . . . . 74.21 110.355 -176.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 502' ' ' ARG . . . . . 0.403 ' HD2' ' HA ' ' A' ' 502' ' ' ARG . 2.1 tpt180 -152.94 123.84 7.41 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.171 -0.678 . . . . 72.42 109.171 173.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -95.03 112.84 24.5 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.191 -0.459 . . . . 64.2 110.39 -176.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.93 124.48 48.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.973 0.416 . . . . 75.3 110.635 178.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.536 ' HD2' ' HA2' ' A' ' 481' ' ' GLY . 1.6 tppp? -91.5 126.38 36.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.706 -0.679 . . . . 75.23 109.577 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -148.12 84.3 1.51 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.327 0.584 . . . . 74.44 110.573 -176.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.4 -127.22 29.01 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.669 -0.696 . . . . 73.15 112.699 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . 0.585 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 26.0 mt-30 -84.66 -3.65 58.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.562 0.22 . . . . 75.42 111.46 -178.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -118.09 153.88 33.02 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.493 0.663 . . . . 71.41 111.176 -177.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . 0.625 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 36.3 m-70 -124.88 126.21 45.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.416 -0.811 . . . . 74.02 109.17 -179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 64.8 m-70 -101.54 117.33 34.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.518 -0.549 . . . . 74.13 109.518 -177.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.461 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 55.4 tp -101.32 121.68 42.32 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.293 -0.412 . . . . 73.44 110.059 178.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 10.8 tp -106.39 130.3 58.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.729 -0.471 . . . . 73.33 109.729 176.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.586 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 54.6 mt -105.47 112.59 39.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.781 -0.822 . . . . 73.02 108.781 171.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -75.34 -48.49 22.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.956 -0.566 . . . . 64.42 110.646 -176.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -122.18 108.41 13.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.87 -0.605 . . . . 71.2 110.125 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -101.82 136.45 41.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.1 -0.5 . . . . 61.55 111.288 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 518' ' ' MET . . . . . 0.413 ' HA ' HG13 ' A' ' 467' ' ' VAL . 9.3 mmt -126.47 175.97 7.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.951 -0.568 . . . . 75.44 110.711 175.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -61.49 -55.66 28.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.38 -0.373 . . . . 75.32 111.586 -171.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -84.14 -10.15 58.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.821 0.343 . . . . 75.42 111.376 -177.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -80.15 -13.0 59.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.128 -0.487 . . . . 52.45 109.876 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.509 ' HA ' HD23 ' A' ' 538' ' ' LEU . . . -70.73 -41.64 71.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.195 -0.457 . . . . 72.22 111.021 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.54 -158.25 0.07 OUTLIER Glycine 0 CA--C 1.523 0.583 0 N-CA-C 114.975 0.75 . . . . 63.51 114.975 176.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -117.22 110.9 18.71 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.271 -0.64 . . . . 73.32 109.271 174.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . 0.655 ' HE1' HD11 ' A' ' 493' ' ' LEU . 30.1 m-85 -85.03 131.72 34.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.489 0.662 . . . . 64.12 111.756 -174.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.78 126.74 25.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.958 -1.019 . . . . 74.13 109.699 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 47.4 tp -87.99 115.29 25.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.135 -0.484 . . . . 75.13 109.971 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . 0.543 ' SG ' HD13 ' A' ' 487' ' ' LEU . 76.3 m -94.61 113.08 24.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.133 0.492 . . . . 72.54 109.864 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.467 ' C ' ' H ' ' A' ' 531' ' ' GLY . 54.6 p -116.85 -166.78 1.2 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.573 -0.74 . . . . 61.53 111.401 -174.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 19.2 m -59.88 6.56 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.792 1.237 . . . . 71.45 113.234 174.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . 0.467 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.47 28.22 1.65 Allowed Glycine 0 C--O 1.228 -0.251 0 C-N-CA 120.992 -0.623 . . . . 74.14 113.677 -176.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -116.55 138.14 14.16 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 109.607 -1.397 . . . . 73.21 109.607 163.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.67 143.31 51.09 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 117.8 0.8 . . . . 73.53 112.302 -172.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -154.59 143.78 21.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.103 -0.953 . . . . 73.01 109.097 175.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.44 HD13 ' N ' ' A' ' 536' ' ' ALA . 3.2 tm? -127.02 135.73 51.24 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.852 -0.425 . . . . 53.03 109.852 -176.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.698 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -135.43 159.99 39.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.267 -0.424 . . . . 74.34 110.561 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -125.56 120.42 30.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.044 -0.526 . . . . 75.41 110.218 -178.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.509 HD23 ' HA ' ' A' ' 522' ' ' ALA . 50.3 tp -99.67 126.99 45.78 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.264 -0.643 . . . . 75.21 109.264 178.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.419 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 66.4 mt -113.79 116.75 53.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 116.372 -0.376 . . . . 71.33 110.323 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.583 HG22 HG23 ' A' ' 465' ' ' VAL . 95.4 t -109.66 134.34 52.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.496 -0.557 . . . . 74.41 109.496 175.269 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.05 164.37 18.71 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.022 -0.733 . . . . 72.42 109.022 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -86.9 105.23 16.93 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.571 -0.529 . . . . 75.55 109.571 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.577 ' HE3' ' HE1' ' A' ' 466' ' ' MET . 53.6 pttt . . . . . 0 C--O 1.247 0.929 0 CA-C-N 115.679 -0.691 . . . . 74.25 109.471 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo . . . . . 0 N--CA 1.458 -0.598 0 N-CA-C 110.644 -0.56 . . . . 75.3 110.644 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.564 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 58.8 t -65.95 114.24 3.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.918 0.389 . . . . 73.33 110.883 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 44.5 tp -89.2 157.77 18.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.686 -0.688 . . . . 64.01 110.545 -177.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . 0.491 HD13 HD23 ' A' ' 527' ' ' LEU . 37.5 mt -101.96 112.61 35.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.052 -0.522 . . . . 75.13 110.087 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 20.9 p -86.49 -26.91 24.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.29 -0.414 . . . . 71.3 111.556 -176.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.472 ' HB3' ' N ' ' A' ' 476' ' ' GLU . 7.1 tpt180 -107.1 114.35 61.42 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.277 -0.42 . . . . 74.42 110.091 177.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.95 158.12 55.78 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 122.589 2.193 . . . . 63.15 111.446 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.591 ' HB3' ' HB1' ' A' ' 536' ' ' ALA . 8.8 mp -73.61 160.45 31.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.115 -0.493 . . . . 64.34 110.574 -178.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . 0.461 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 0.2 OUTLIER -65.0 146.99 54.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.512 0.673 . . . . 72.44 112.216 -173.599 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -104.35 7.36 35.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.933 -1.031 . . . . 71.54 112.515 -171.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . 0.435 HE22 ' HB3' ' A' ' 461' ' ' GLU . 0.2 OUTLIER -124.49 154.13 40.99 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.872 -0.731 . . . . 74.25 111.805 -167.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.571 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.3 pt? -118.44 145.46 45.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.825 -1.079 . . . . 70.01 111.414 -168.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 29.3 m -119.77 177.15 3.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 71.43 111.485 -176.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -107.83 172.03 7.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.919 -0.582 . . . . 74.22 110.383 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 40.3 t -62.45 130.31 26.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.455 -0.339 . . . . 72.43 110.995 -178.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 90.54 7.37 67.02 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.776 -0.726 . . . . 73.33 112.626 178.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -117.85 138.73 51.91 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.884 0.373 . . . . 74.51 110.525 178.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . 0.549 ' O ' ' HD3' ' A' ' 470' ' ' ARG . 0.0 OUTLIER -82.02 153.6 26.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.697 -0.683 . . . . 74.34 111.451 -179.124 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.452 HG12 ' HB ' ' A' ' 514' ' ' ILE . 7.4 p -145.42 131.08 13.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.991 -0.549 . . . . 73.02 110.58 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.433 ' CG ' HD13 ' A' ' 513' ' ' ILE . 41.0 mt-10 -99.37 128.21 45.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.433 -0.349 . . . . 74.3 110.964 177.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.461 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 92.9 m-85 -107.6 112.16 24.75 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.625 -0.88 . . . . 74.04 108.625 167.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -96.45 140.24 31.38 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.232 0.539 . . . . 75.1 110.623 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.572 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 8.7 p -139.25 137.81 36.24 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.451 -0.795 . . . . 75.31 109.779 176.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.472 ' N ' ' HB3' ' A' ' 458' ' ' ARG . 45.3 mt-10 -119.46 138.98 52.78 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.529 -0.545 . . . . 70.5 109.529 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.564 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 9.6 m -122.58 152.14 26.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 116.106 -0.497 . . . . 74.41 110.917 -177.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 6.5 m -63.19 -19.63 64.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.818 -0.628 . . . . 74.12 112.094 -178.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . 0.497 ' HB3' ' HB3' ' A' ' 482' ' ' ALA . 35.8 tt0 -108.75 135.25 50.28 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.819 0.342 . . . . 75.32 110.437 -176.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . 0.649 ' HA ' ' HG2' ' A' ' 508' ' ' GLN . 13.7 pt-20 -75.49 135.96 40.64 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.177 -0.465 . . . . 71.34 110.577 -178.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . 0.433 ' HA2' ' HD3' ' A' ' 505' ' ' LYS . . . 67.05 8.74 51.26 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.145 -0.55 . . . . 74.45 113.075 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.497 ' HB3' ' HB3' ' A' ' 479' ' ' GLU . . . -57.67 139.59 53.36 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 120.849 0.356 . . . . 74.23 111.221 -177.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -79.43 128.29 33.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.648 -0.705 . . . . 72.2 110.143 -177.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.552 ' HB ' HD13 ' A' ' 527' ' ' LEU . 32.7 m -121.88 150.85 25.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.253 -0.431 . . . . 73.15 110.258 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -134.83 134.98 41.39 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.766 -0.457 . . . . 73.43 109.766 179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . 0.422 ' CD2' HD21 ' A' ' 512' ' ' LEU . 72.0 m95 -103.34 131.46 50.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.919 0.39 . . . . 75.52 111.165 -175.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . 0.548 ' HG ' ' HA ' ' A' ' 492' ' ' GLU . 10.7 mp -120.02 158.02 27.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.903 -0.589 . . . . 72.14 109.47 174.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.47 ' HE2' ' HB3' ' A' ' 488' ' ' LYS . 1.7 tmmm? -140.81 109.27 5.88 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.116 -0.327 . . . . 75.45 110.116 -178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 57.63 35.4 25.64 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.898 -0.592 . . . . 74.42 111.061 -177.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 86.94 -11.78 63.76 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.778 -0.646 . . . . 72.24 112.741 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 60.7 t -79.03 122.95 35.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.805 -0.443 . . . . 44.32 109.805 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . 0.548 ' HA ' ' HG ' ' A' ' 487' ' ' LEU . 33.4 tt0 -78.71 111.31 14.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.902 -0.59 . . . . 74.41 110.2 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 86.9 mt -68.37 134.94 51.03 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.016 0.436 . . . . 63.24 110.177 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 14.3 t -91.58 160.16 15.54 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.978 -0.555 . . . . 74.13 110.024 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 -125.82 11.94 7.84 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.813 -0.63 . . . . 74.31 110.559 -177.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -75.55 -35.06 60.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.613 -0.721 . . . . 74.43 109.801 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -136.23 139.6 42.86 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.621 -0.881 . . . . 74.22 108.621 170.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' THR . . . . . 0.552 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.6 OUTLIER -150.37 88.01 1.48 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.434 0.635 . . . . 74.11 111.166 179.094 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -104.94 -17.97 14.35 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.591 -0.732 . . . . 74.03 109.912 174.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -92.72 -47.05 7.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.733 -0.667 . . . . 65.41 109.841 174.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.552 ' O ' ' HB ' ' A' ' 498' ' ' THR . 45.6 m-85 -103.17 161.21 13.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.928 -0.578 . . . . 74.53 109.926 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 502' ' ' ARG . . . . . 0.454 ' HB2' HG22 ' A' ' 513' ' ' ILE . 49.1 mtp180 -144.34 135.49 25.35 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.175 -0.676 . . . . 71.3 109.175 174.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -107.4 113.14 26.31 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.475 -0.565 . . . . 75.43 109.475 -175.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -120.4 145.83 46.8 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.858 -0.61 . . . . 73.14 110.968 -172.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.433 ' HD3' ' HA2' ' A' ' 481' ' ' GLY . 3.7 ttmp? -128.82 118.42 22.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.847 -0.615 . . . . 73.14 109.846 -178.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . 0.515 ' HB3' ' HG3' ' A' ' 509' ' ' ARG . 15.3 t70 -127.62 82.73 2.1 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.421 -0.585 . . . . 73.31 109.421 177.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.37 -101.18 0.59 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.059 -0.591 . . . . 75.42 112.041 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . 0.649 ' HG2' ' HA ' ' A' ' 480' ' ' GLU . 20.9 mt-30 -109.19 -8.63 15.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.824 0.345 . . . . 73.42 110.822 -179.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.515 ' HG3' ' HB3' ' A' ' 506' ' ' ASP . 36.7 ptt180 -104.94 133.25 50.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.363 0.601 . . . . 61.15 110.761 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . 0.572 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 83.2 m-70 -113.65 144.62 42.61 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.818 -0.628 . . . . 73.42 109.792 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -119.8 118.32 30.51 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 110.134 -0.321 . . . . 71.01 110.134 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 486' ' ' TRP . 53.2 tp -96.55 103.5 15.42 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.597 -0.89 . . . . 64.2 108.597 170.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.531 HD12 ' HB2' ' A' ' 470' ' ' ARG . 5.4 tp -101.34 112.63 34.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 121.482 0.658 . . . . 61.52 110.505 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 60.9 mt -86.46 115.53 27.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 108.482 -0.933 . . . . 70.44 108.482 174.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -68.82 -51.52 39.84 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.961 0.41 . . . . 72.34 110.537 -177.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -133.76 109.41 9.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.802 -0.636 . . . . 74.53 109.841 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -88.0 138.43 31.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.974 0.416 . . . . 71.42 111.017 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 518' ' ' MET . . . . . 0.615 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 25.4 mmt -109.34 170.12 8.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.923 -0.58 . . . . 72.35 110.371 179.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . 0.511 HD13 ' HG3' ' A' ' 542' ' ' GLU . 3.0 mm? -64.24 -53.52 47.78 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.241 -0.436 . . . . 72.13 111.229 -173.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -81.38 -5.06 57.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.262 -0.426 . . . . 75.43 110.907 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . 0.615 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 7.9 t70 -86.8 -14.56 41.87 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.088 -0.505 . . . . 74.02 110.57 -176.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.511 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -69.16 -43.67 73.81 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.817 -0.353 . . . . 75.51 111.344 -175.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . 0.448 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 40.27 -158.53 0.02 OUTLIER Glycine 0 CA--C 1.524 0.655 0 N-CA-C 115.9 1.12 . . . . 74.41 115.9 172.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -111.14 111.55 22.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.78 -0.71 . . . . 73.13 109.086 170.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -86.19 131.53 34.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.028 0.442 . . . . 71.24 111.103 -179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -132.27 126.09 32.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.589 -0.732 . . . . 72.21 110.073 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.552 HD13 ' HB ' ' A' ' 484' ' ' VAL . 45.5 tp -86.9 119.92 27.63 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.196 -0.456 . . . . 73.23 110.12 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . 0.496 ' SG ' HD12 ' A' ' 487' ' ' LEU . 86.4 m -100.88 112.97 25.51 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.457 -0.571 . . . . 72.44 109.457 177.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.559 ' C ' ' H ' ' A' ' 531' ' ' GLY . 0.2 OUTLIER -115.89 -168.39 1.41 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.642 -0.708 . . . . 65.12 110.389 -175.946 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 530' ' ' SER . . . . . 0.413 ' H ' HG22 ' A' ' 529' ' ' THR . 7.5 m -55.21 7.25 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.935 1.294 . . . . 70.42 113.694 173.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . 0.559 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.9 26.83 2.01 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-O 121.638 0.577 . . . . 72.43 111.831 -168.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -114.91 150.23 18.74 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 109.684 -1.366 . . . . 52.41 109.684 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . 0.401 ' NE2' ' H ' ' A' ' 534' ' ' ALA . 0.0 OUTLIER -134.77 142.75 46.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 117.55 0.675 . . . . 72.03 110.762 -176.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . 0.401 ' H ' ' NE2' ' A' ' 533' ' ' GLN . . . -153.06 123.48 7.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.656 -0.702 . . . . 72.44 109.778 177.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.427 HD12 ' N ' ' A' ' 536' ' ' ALA . 2.7 tm? -103.99 132.82 49.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.173 -0.467 . . . . 74.51 110.114 -177.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.591 ' HB1' ' HB3' ' A' ' 460' ' ' LEU . . . -121.02 149.25 42.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.37 -0.377 . . . . 72.4 110.42 177.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -116.31 120.58 39.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.173 -0.467 . . . . 62.12 110.084 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.443 HD21 ' HA ' ' A' ' 522' ' ' ALA . 48.3 tp -127.51 134.73 49.78 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.284 -0.416 . . . . 72.52 110.462 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.571 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.8 mp -130.8 125.23 58.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.128 -0.693 . . . . 64.13 109.128 174.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.511 HG21 ' HB1' ' A' ' 522' ' ' ALA . 70.1 t -104.41 143.71 15.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 110.02 -0.363 . . . . 72.14 110.02 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.29 150.26 48.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.756 0.312 . . . . 70.15 110.628 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . 0.511 ' HG3' HD13 ' A' ' 519' ' ' LEU . 45.2 mt-10 -89.5 123.33 33.51 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.698 -0.683 . . . . 72.52 110.185 175.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.5 ' HD2' ' C ' ' A' ' 543' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.89 0 CA-C-N 115.6 -0.727 . . . . 72.44 109.809 177.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo . . . . . 0 N--CA 1.462 -0.367 0 CA-C-O 120.723 0.218 . . . . 72.33 111.662 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.447 ' H ' ' HB2' ' A' ' 530' ' ' SER . 87.2 t -64.51 108.79 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.215 0.531 . . . . 73.24 110.408 178.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 50.1 tp -80.63 139.29 36.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.595 -0.73 . . . . 73.54 110.17 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 55.1 mt -91.14 114.93 29.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.867 -0.606 . . . . 72.32 109.789 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 24.7 p -86.2 -17.96 33.44 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.264 0.554 . . . . 75.33 111.498 -175.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.415 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 10.9 tpt85 -136.95 104.64 8.87 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.955 -0.566 . . . . 73.45 110.359 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . 0.444 ' HA ' ' HB2' ' A' ' 534' ' ' ALA . 26.2 Cg_exo -62.71 167.38 11.87 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.891 2.394 . . . . 74.05 111.285 174.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.676 ' HB2' ' CB ' ' A' ' 536' ' ' ALA . 0.8 OUTLIER -69.81 167.84 16.37 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.606 -0.516 . . . . 63.53 109.606 -177.79 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . 0.523 ' HA ' ' OE1' ' A' ' 461' ' ' GLU . 2.4 tp10 -73.15 161.59 30.42 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.264 0.554 . . . . 74.34 111.64 -172.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -104.25 8.76 36.16 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.989 1.107 . . . . 74.52 113.989 -166.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.11 154.23 37.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.381 0.991 . . . . 54.23 112.471 -165.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.674 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.5 pt? -106.56 146.83 30.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.051 -1.431 . . . . 74.3 111.576 -170.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.444 HG23 HD11 ' A' ' 538' ' ' LEU . 30.1 m -123.36 177.41 4.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.006 0.431 . . . . 65.32 111.457 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -97.5 166.75 11.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.008 -0.542 . . . . 74.23 110.986 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 38.3 t -62.08 127.35 21.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.716 -0.675 . . . . 53.12 111.604 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 88.16 -13.35 61.82 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.003 -0.617 . . . . 72.04 113.144 174.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -87.58 144.58 26.62 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.95 -0.389 . . . . 74.44 109.95 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . 0.608 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 2.3 ppt_? -76.65 145.56 38.74 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.276 0.56 . . . . 65.22 111.234 -177.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.435 HG12 ' HB ' ' A' ' 514' ' ' ILE . 7.2 p -131.9 142.26 43.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.674 -0.694 . . . . 72.43 109.978 178.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.498 ' HG2' HD12 ' A' ' 513' ' ' ILE . 34.1 mt-10 -112.19 125.3 53.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 75.54 110.546 -176.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.502 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 59.6 m-85 -112.88 123.2 49.77 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.287 -0.415 . . . . 75.02 111.34 178.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -95.02 138.33 32.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.736 -0.666 . . . . 75.51 110.543 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.622 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 6.0 p -148.81 133.3 17.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.25 -0.432 . . . . 72.12 110.387 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.468 ' HG2' ' CB ' ' A' ' 509' ' ' ARG . 43.9 mt-10 -131.78 139.81 49.02 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.36 -0.237 . . . . 71.01 110.36 -178.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 30.1 m -123.41 161.15 25.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.343 -0.39 . . . . 72.12 110.488 177.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 34.3 t -80.9 8.47 8.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.271 -0.422 . . . . 61.14 112.114 -175.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 4.5 tp10 -128.85 141.27 51.35 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.029 -0.359 . . . . 75.12 110.029 -179.194 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . 0.479 ' HA ' ' HG2' ' A' ' 508' ' ' GLN . 1.0 OUTLIER -88.84 136.92 32.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.746 0.308 . . . . 75.24 110.426 -178.954 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 60.55 31.75 75.79 Favored Glycine 0 C--N 1.33 0.217 0 C-N-CA 120.706 -0.759 . . . . 75.24 111.783 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.492 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -74.46 146.27 42.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.951 0.405 . . . . 63.25 111.303 -175.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . 0.443 ' CD ' ' H ' ' A' ' 483' ' ' GLN . 0.0 OUTLIER -78.2 111.33 14.02 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.764 -0.653 . . . . 63.14 110.326 179.318 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.54 HG13 HG23 ' A' ' 529' ' ' THR . 17.3 m -131.86 151.21 34.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.666 -0.697 . . . . 71.4 110.245 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -135.06 155.13 51.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.902 0.382 . . . . 75.2 110.196 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . 0.528 ' HB3' HD11 ' A' ' 493' ' ' LEU . 52.2 m95 -105.57 127.24 52.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.132 -0.486 . . . . 70.51 110.908 -179.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . 0.54 HD13 ' SG ' ' A' ' 528' ' ' CYS . 65.1 mt -123.96 136.59 54.41 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.847 -0.615 . . . . 73.01 109.415 175.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.494 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 3.3 tmmm? -120.65 106.47 11.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.303 -0.408 . . . . 71.34 110.215 -177.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . 0.533 ' HB2' ' H ' ' A' ' 524' ' ' HIS . 13.7 t70 57.14 35.55 26.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.541 -0.754 . . . . 72.05 110.86 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 88.43 -3.72 85.28 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.794 -0.639 . . . . 71.34 112.513 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 89.5 t -94.69 128.2 46.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.722 0.296 . . . . 71.11 110.818 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . 0.517 ' HA ' ' CD2' ' A' ' 487' ' ' LEU . 4.7 tp10 -70.01 126.96 31.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.847 -0.615 . . . . 73.51 110.432 178.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.528 HD11 ' HB3' ' A' ' 486' ' ' TRP . 75.8 mt -87.55 98.01 11.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.119 0.485 . . . . 60.54 109.753 175.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' THR . . . . . 0.493 ' OG1' ' HG2' ' A' ' 496' ' ' GLU . 6.2 t -64.27 123.33 18.84 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.599 -0.728 . . . . 72.04 111.223 -176.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . 0.573 ' H ' ' NE ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -100.61 13.07 35.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.042 -0.526 . . . . 73.45 110.768 -179.264 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . 0.493 ' HG2' ' OG1' ' A' ' 494' ' ' THR . 10.1 mm-40 -69.22 -36.66 77.48 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.325 -0.62 . . . . 74.32 109.325 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -151.53 108.22 3.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.143 -0.935 . . . . 71.51 109.364 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' THR . . . . . 0.596 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 21.3 p -114.42 97.8 6.53 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.154 -0.475 . . . . 73.45 111.547 -176.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -91.03 -28.95 17.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.9 -0.591 . . . . 74.12 110.192 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -88.76 -46.97 8.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.941 -0.572 . . . . 75.45 110.312 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.596 ' O ' ' HB ' ' A' ' 498' ' ' THR . 26.2 m-85 -99.32 154.96 17.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.624 -0.716 . . . . 75.14 110.093 -176.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 502' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 501' ' ' TYR . 21.5 mtp85 -148.09 123.17 10.12 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.549 -0.537 . . . . 75.53 109.549 171.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . 0.456 ' HE2' HG21 ' A' ' 498' ' ' THR . 72.6 m-85 -96.06 118.37 32.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.02 -0.537 . . . . 72.32 111.465 -172.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.542 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 4.6 mptp? -105.85 146.0 30.49 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.239 -0.437 . . . . 72.41 110.054 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.435 ' HD3' ' CE1' ' A' ' 510' ' ' HIS . 26.5 ttpt -129.37 128.06 42.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.85 0.357 . . . . 71.55 111.149 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -119.05 79.03 1.34 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.657 -0.701 . . . . 75.13 109.512 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.49 -90.78 0.24 Allowed Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.838 -0.619 . . . . 53.13 112.807 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . 0.479 ' HG2' ' HA ' ' A' ' 480' ' ' GLU . 22.7 mt-30 -99.14 -26.06 14.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.804 0.335 . . . . 74.53 111.019 -177.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.468 ' CB ' ' HG2' ' A' ' 476' ' ' GLU . 17.1 ptt180 -103.55 153.74 20.24 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.21 0.529 . . . . 74.03 111.485 -173.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . 0.622 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 64.3 m-70 -124.64 156.54 37.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.045 -0.525 . . . . 74.11 110.76 -179.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . 0.542 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 42.0 m-70 -125.99 119.3 27.34 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.08 -0.711 . . . . 75.14 109.08 176.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.502 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 64.4 tp -98.3 105.68 17.86 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.447 -0.575 . . . . 75.24 109.447 174.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.498 HD12 ' HG2' ' A' ' 472' ' ' GLU . 8.5 tp -97.54 112.81 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 CA-C-O 121.502 0.668 . . . . 55.13 109.571 176.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.608 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 45.1 mt -96.66 112.08 28.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.611 -0.885 . . . . 61.03 108.611 175.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -68.81 -45.01 72.32 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.445 0.466 . . . . 74.03 111.353 -173.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -134.32 109.59 8.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.198 -0.456 . . . . 73.53 110.185 178.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . 0.473 ' HB3' HG22 ' A' ' 540' ' ' VAL . . . -88.27 123.07 32.51 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.097 -0.501 . . . . 74.14 110.344 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 518' ' ' MET . . . . . 0.703 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 30.2 mmt -90.05 173.36 8.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.256 -0.429 . . . . 75.12 110.103 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.32 -54.03 50.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.949 0.404 . . . . 75.1 110.853 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -82.89 -4.48 58.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.752 -0.658 . . . . 73.11 111.103 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . 0.703 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 6.8 t70 -80.41 -19.78 45.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.305 -176.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.5 ' HA ' HD23 ' A' ' 538' ' ' LEU . . . -62.66 -41.93 99.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.147 -0.479 . . . . 74.14 111.268 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.19 -157.32 0.07 OUTLIER Glycine 0 C--N 1.335 0.513 0 O-C-N 123.924 0.765 . . . . 65.2 114.811 173.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . 0.533 ' H ' ' HB2' ' A' ' 489' ' ' ASP . 60.5 m80 -120.66 108.65 14.27 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.734 -0.839 . . . . 74.25 108.734 171.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . 0.494 ' CZ ' ' HG3' ' A' ' 488' ' ' LYS . 26.3 m-85 -85.46 132.04 34.28 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.472 0.654 . . . . 74.2 111.857 -173.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -141.29 131.86 25.46 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.113 -0.949 . . . . 73.3 109.818 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.469 HD22 ' HB2' ' A' ' 475' ' ' CYS . 61.2 tp -86.67 116.3 24.69 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.245 -0.65 . . . . 71.44 109.245 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . 0.54 ' SG ' HD13 ' A' ' 487' ' ' LEU . 64.6 m -99.73 116.31 31.52 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.424 0.63 . . . . 73.14 110.597 -176.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.567 ' C ' ' H ' ' A' ' 531' ' ' GLY . 68.0 p -115.64 -165.67 1.06 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.95 -1.023 . . . . 71.43 110.229 -177.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 530' ' ' SER . . . . . 0.447 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 2.7 m -52.68 4.25 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.645 1.178 . . . . 70.04 113.274 172.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . 0.567 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.85 27.59 1.87 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.392 -0.432 . . . . 75.5 113.233 -175.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -107.95 136.22 13.32 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 109.797 -1.321 . . . . 54.22 109.797 164.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -113.03 121.06 43.48 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 117.201 0.5 . . . . 72.43 112.224 -171.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . 0.444 ' HB2' ' HA ' ' A' ' 459' ' ' PRO . . . -121.26 140.21 52.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.933 -0.576 . . . . 74.01 109.474 171.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.485 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.8 tm? -128.36 138.94 52.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.767 0.318 . . . . 75.4 110.48 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.676 ' CB ' ' HB2' ' A' ' 460' ' ' LEU . . . -146.94 159.92 42.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 74.53 110.112 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -127.04 116.75 21.21 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.057 0.456 . . . . 74.3 111.057 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.5 HD23 ' HA ' ' A' ' 522' ' ' ALA . 52.6 tp -101.22 133.08 46.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.038 -0.727 . . . . 74.42 109.038 175.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.674 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 35.5 mt -125.49 116.7 47.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 109.762 -0.459 . . . . 74.22 109.762 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.473 HG22 ' HB3' ' A' ' 517' ' ' ALA . 97.8 t -112.81 120.16 62.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 120.771 0.319 . . . . 73.44 110.513 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.58 162.21 30.86 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.943 -0.571 . . . . 74.1 109.798 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -85.33 109.12 18.16 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.44 -0.578 . . . . 64.24 109.44 173.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.831 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 10.7 mmpt? . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.426 -0.797 . . . . 73.44 109.701 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo . . . . . 0 N--CA 1.459 -0.501 0 N-CA-C 111.287 -0.313 . . . . 74.45 111.287 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.438 ' H ' ' HB2' ' A' ' 530' ' ' SER . 99.2 t -64.93 107.67 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-O 121.199 0.523 . . . . 71.31 110.063 176.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 47.3 tp -93.63 152.54 18.93 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.512 -0.767 . . . . 72.41 109.562 -177.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 56.6 mt -105.71 112.9 41.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.205 -0.452 . . . . 74.42 110.234 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 43.8 p -86.43 -33.91 20.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.181 0.515 . . . . 73.14 110.416 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.41 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 14.3 tpt180 -114.77 103.91 54.54 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.541 -0.754 . . . . 75.54 109.26 174.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.2 167.57 19.86 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.968 2.445 . . . . 65.44 112.272 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.842 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 79.6 mt -66.11 155.24 37.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.032 -0.531 . . . . 74.1 110.078 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -88.35 162.68 16.42 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.302 0.853 . . . . 73.31 113.302 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -104.53 6.33 34.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.245 -1.343 . . . . 74.31 113.93 -161.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -123.86 149.31 45.94 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 118.923 -1.111 . . . . 62.42 112.753 -162.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.601 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 0.6 OUTLIER -114.48 144.9 42.6 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.97 -1.468 . . . . 71.41 111.391 -170.523 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 28.2 m -117.92 177.93 2.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.115 -0.493 . . . . 63.22 111.303 -177.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -103.14 168.07 9.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.012 -0.54 . . . . 71.33 110.382 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 45.0 t -62.21 130.33 26.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.472 -0.331 . . . . 72.24 110.829 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 92.46 -11.22 72.61 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.877 -0.678 . . . . 70.22 112.616 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -101.09 144.17 30.32 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.431 -0.581 . . . . 73.42 109.431 178.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . 0.494 ' HD2' ' C ' ' A' ' 470' ' ' ARG . 0.0 OUTLIER -86.01 150.61 24.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.965 0.412 . . . . 73.21 110.72 -176.13 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 8.0 p -128.94 137.59 56.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.445 -0.576 . . . . 55.33 109.445 176.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.846 ' HG2' HG13 ' A' ' 513' ' ' ILE . 42.6 mt-10 -116.61 124.28 49.41 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.489 -0.323 . . . . 74.33 110.159 -176.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.435 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 76.9 m-85 -107.97 113.27 26.33 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.116 -0.493 . . . . 71.12 110.286 176.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -95.61 132.36 40.84 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.657 -0.701 . . . . 74.35 110.295 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.4 t -148.26 121.02 8.66 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.095 0.474 . . . . 53.43 110.507 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.87 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 46.5 mt-10 -112.63 138.72 49.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.799 -0.637 . . . . 73.32 110.058 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.441 ' O ' ' HB3' ' A' ' 508' ' ' GLN . 21.6 m -121.93 178.44 2.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.383 -0.371 . . . . 65.41 110.781 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 25.0 p -78.22 -21.61 49.73 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.598 0.592 . . . . 71.41 112.598 -174.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . 0.523 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 35.9 tt0 -119.02 138.91 52.5 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.997 0.427 . . . . 73.21 110.991 -175.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -74.41 126.96 31.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.955 -0.566 . . . . 71.11 110.368 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 64.35 26.84 70.93 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.616 -0.802 . . . . 52.33 111.953 -174.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.523 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -57.94 156.76 8.65 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.012 0.745 . . . . 62.33 113.012 -176.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -71.86 105.48 3.82 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.886 -1.052 . . . . 75.04 109.553 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.51 ' HB ' HD13 ' A' ' 527' ' ' LEU . 29.3 m -128.06 150.7 34.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.908 0.385 . . . . 73.1 110.412 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 49.4 tttp -130.29 126.8 38.13 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.206 -0.664 . . . . 74.35 109.206 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . 0.413 ' HB3' HD11 ' A' ' 493' ' ' LEU . 86.1 m95 -100.92 116.81 33.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.739 0.304 . . . . 73.44 110.885 -175.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . 0.416 HD12 ' SG ' ' A' ' 528' ' ' CYS . 7.7 mp -118.23 140.8 49.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.035 -0.529 . . . . 74.02 110.393 177.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.527 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 4.2 tmmm? -127.22 107.45 10.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.142 -0.688 . . . . 75.25 109.142 176.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 4.7 t70 58.56 35.55 24.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.577 0.703 . . . . 73.12 110.353 -178.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 92.99 -15.58 62.5 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.824 -0.703 . . . . 71.55 113.281 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 55.9 t -97.85 123.99 50.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.81 0.305 . . . . 72.43 110.561 -178.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -70.44 142.6 51.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.932 0.396 . . . . 74.04 110.75 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.728 HD12 ' HE2' ' A' ' 525' ' ' TYR . 59.7 mt -84.71 118.39 24.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.901 -0.59 . . . . 75.41 110.197 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 10.6 t -70.46 143.14 51.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.06 0.457 . . . . 72.21 110.414 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.93 7.64 11.52 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.177 -0.465 . . . . 74.44 110.596 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -62.18 -50.38 72.06 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.517 0.675 . . . . 75.02 109.579 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -152.65 118.16 5.3 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.81 -1.086 . . . . 75.52 108.82 174.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.61 121.65 16.76 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.85 0.357 . . . . 73.44 110.597 -176.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -107.49 -22.9 12.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.272 -0.422 . . . . 73.12 111.51 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . 0.41 ' HE3' ' CE2' ' A' ' 501' ' ' TYR . 52.3 mtmt -73.97 -46.74 42.01 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.422 -0.585 . . . . 74.22 109.422 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.703 ' HB3' HG12 ' A' ' 514' ' ' ILE . 0.6 OUTLIER -136.09 144.98 45.45 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.282 -0.872 . . . . 73.51 110.298 179.032 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.88 140.32 51.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.068 0.461 . . . . 74.31 110.922 178.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -95.64 120.55 36.09 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.242 -0.89 . . . . 64.21 109.789 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.547 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 0.7 OUTLIER -113.54 121.31 43.83 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.072 0.463 . . . . 74.44 110.964 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -107.51 113.51 26.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.588 -0.733 . . . . 73.31 110.476 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.53 101.4 3.98 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.426 0.631 . . . . 74.0 110.581 174.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 80.06 -131.14 10.3 Favored Glycine 0 N--CA 1.444 -0.83 0 CA-C-N 115.456 -0.793 . . . . 71.33 111.895 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . 0.441 ' HB3' ' O ' ' A' ' 477' ' ' VAL . 26.0 mt-30 -93.47 -10.63 34.34 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.817 0.341 . . . . 62.24 110.567 -178.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.87 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 25.5 ptt180 -93.52 143.83 25.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.546 0.688 . . . . 71.31 111.508 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 -124.5 117.71 24.98 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.441 -0.948 . . . . 73.33 108.441 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . 0.547 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 13.3 m-70 -101.84 127.57 48.59 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.677 -0.238 . . . . 75.03 110.739 -172.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.435 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 63.0 tp -112.7 103.55 11.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.596 -0.52 . . . . 73.53 109.596 173.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.846 HG13 ' HG2' ' A' ' 472' ' ' GLU . 1.7 mp -105.08 116.28 48.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.1 -0.5 . . . . 60.43 110.329 179.248 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.703 HG12 ' HB3' ' A' ' 501' ' ' TYR . 53.7 mt -97.81 112.78 30.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.075 -0.713 . . . . 73.5 109.075 175.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -71.19 -44.25 65.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.091 -0.504 . . . . 72.32 110.542 -175.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -129.86 109.14 10.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.911 -0.586 . . . . 72.32 109.758 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -89.98 132.16 35.5 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.062 -0.517 . . . . 70.21 110.335 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 26.1 mmt -112.06 166.51 11.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.076 -0.511 . . . . 73.11 110.554 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -58.18 -53.92 52.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 75.42 111.077 -174.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -82.6 -10.78 58.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.075 -0.511 . . . . 74.42 111.651 -176.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -85.9 -14.03 46.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.44 -0.346 . . . . 73.44 110.466 -177.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.464 ' HB3' HG23 ' A' ' 540' ' ' VAL . . . -62.72 -41.98 99.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.313 -0.403 . . . . 71.4 111.361 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.68 -158.13 0.08 OUTLIER Glycine 0 C--N 1.337 0.589 0 O-C-N 123.835 0.709 . . . . 61.22 114.472 176.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -126.97 112.38 15.2 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.605 -0.887 . . . . 74.02 108.605 172.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . 0.728 ' HE2' HD12 ' A' ' 493' ' ' LEU . 51.7 m-85 -85.74 131.97 34.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.238 0.542 . . . . 75.21 111.494 -172.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -137.55 120.07 16.02 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.553 -0.749 . . . . 73.53 110.035 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.51 HD13 ' HB ' ' A' ' 484' ' ' VAL . 45.2 tp -87.6 123.35 32.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.152 -0.476 . . . . 75.3 109.775 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . 0.416 ' SG ' HD12 ' A' ' 487' ' ' LEU . 64.6 m -108.68 112.73 25.19 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.054 0.454 . . . . 72.53 110.202 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.596 ' C ' ' H ' ' A' ' 531' ' ' GLY . 55.1 p -114.61 -165.2 0.99 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.085 -0.507 . . . . 74.32 109.716 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 530' ' ' SER . . . . . 0.438 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 2.1 m -49.79 4.53 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.087 1.143 . . . . 71.24 114.087 173.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . 0.596 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.55 26.84 2.08 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 121.446 0.47 . . . . 74.12 112.789 -173.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -109.04 138.02 14.52 Favored Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 109.21 -1.556 . . . . 73.21 109.21 164.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.74 126.14 46.91 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 117.31 0.555 . . . . 71.41 111.201 -171.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -131.89 133.88 45.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.79 -0.641 . . . . 73.54 109.636 174.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.477 HD13 ' N ' ' A' ' 536' ' ' ALA . 1.4 tm? -116.81 133.69 55.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.933 -0.395 . . . . 72.13 109.933 -177.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.842 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -122.09 131.22 53.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.431 -0.35 . . . . 74.44 110.801 178.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -102.41 116.41 32.56 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.112 -0.494 . . . . 72.33 110.149 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.457 HD21 ' HA ' ' A' ' 522' ' ' ALA . 33.6 tp -124.11 118.75 27.63 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.266 -0.425 . . . . 74.24 110.088 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.601 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.2 mp -124.21 109.68 23.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 109.065 -0.717 . . . . 75.54 109.065 176.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.464 HG23 ' HB3' ' A' ' 522' ' ' ALA . 73.0 t -89.88 129.16 41.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.118 0.485 . . . . 75.51 110.249 -177.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -116.04 168.4 10.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.46 -0.791 . . . . 71.02 110.222 -174.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -115.03 108.68 17.0 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.524 -0.307 . . . . 73.2 110.563 174.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 50.1 pttt . . . . . 0 C--O 1.247 0.93 0 CA-C-N 115.569 -0.742 . . . . 75.04 110.093 177.125 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.81 0 N-CA-C 111.639 -0.584 . . . . 71.4 111.639 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 10.7 m -84.2 96.72 9.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.959 0.409 . . . . 73.03 110.162 178.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 15.2 p80 -130.34 11.95 5.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.218 -0.446 . . . . 74.33 110.452 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 25.2 ptm -75.87 125.14 88.6 Favored Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 109.549 -0.537 . . . . 75.13 109.549 175.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.75 133.43 12.71 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.046 1.831 . . . . 73.44 112.267 -177.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.53 ' HB ' ' HB2' ' A' ' 530' ' ' SER . 65.6 t -65.94 108.78 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.295 -0.631 . . . . 73.43 109.295 172.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 54.7 tp -95.15 137.29 34.4 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.426 -0.807 . . . . 71.13 110.269 -175.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 58.1 mt -80.29 101.48 5.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.072 -0.714 . . . . 73.22 109.072 175.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 6.5 p -74.42 -18.97 60.57 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.909 -0.587 . . . . 62.42 111.964 -173.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . . . . . . . . . 36.7 tpt85 -122.97 108.08 32.8 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.438 -0.346 . . . . 74.22 110.122 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.92 158.95 27.1 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 123.146 2.564 . . . . 73.25 112.48 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.585 ' HB3' ' HB3' ' A' ' 536' ' ' ALA . 94.9 mt -80.93 160.81 24.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.888 -0.596 . . . . 60.31 111.459 -174.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . 0.662 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 0.1 OUTLIER -65.91 139.59 58.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.652 -0.703 . . . . 71.43 112.069 -175.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -106.12 10.74 31.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.92 -1.037 . . . . 62.22 112.331 -173.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . 0.402 ' OE1' ' HG3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -120.63 153.03 37.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 119.685 -0.806 . . . . 72.34 112.362 -163.733 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.2 pt? -91.7 146.7 23.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.164 -1.38 . . . . 75.4 112.072 -169.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.504 HG22 HG22 ' A' ' 540' ' ' VAL . 28.2 m -125.32 178.43 3.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.822 -0.627 . . . . 65.42 111.121 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -118.36 161.65 19.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.095 -0.502 . . . . 75.22 110.775 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 52.7 t -66.17 126.59 25.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 74.03 110.738 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 95.13 -3.97 67.2 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.75 -0.738 . . . . 75.01 112.304 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -104.91 150.61 24.73 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.89 -0.411 . . . . 74.21 109.89 178.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . 0.461 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 17.3 ptp180 -81.58 153.19 26.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.984 0.421 . . . . 74.13 110.957 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.449 HG23 HG21 ' A' ' 465' ' ' VAL . 2.3 t -120.57 119.33 59.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.044 -0.525 . . . . 72.52 109.93 177.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -106.02 119.18 38.54 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.064 -0.347 . . . . 64.13 110.064 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.662 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 98.3 m-85 -108.85 139.31 43.86 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.884 -0.598 . . . . 64.35 110.28 174.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.95 123.85 50.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.544 -0.298 . . . . 73.22 110.31 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 26.8 p -149.39 135.44 18.94 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.912 0.387 . . . . 75.01 110.479 177.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.41 ' HA ' ' HA ' ' A' ' 509' ' ' ARG . 43.8 mt-10 -128.18 155.52 44.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.895 -0.593 . . . . 73.31 109.437 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.452 HG21 ' HB3' ' A' ' 482' ' ' ALA . 14.2 m -125.3 166.68 20.66 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 116.424 -0.353 . . . . 74.51 110.461 177.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 25.8 p -78.93 8.4 5.64 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.438 0.533 . . . . 61.21 112.438 -174.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . 0.519 ' HB3' ' HB1' ' A' ' 482' ' ' ALA . 37.1 tt0 -144.54 133.93 23.19 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.048 -0.353 . . . . 75.32 110.048 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -79.0 134.11 36.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.317 0.579 . . . . 72.02 110.731 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . 0.504 ' HA2' ' HD3' ' A' ' 505' ' ' LYS . . . 71.4 16.28 75.48 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.47 -0.786 . . . . 72.24 112.118 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.519 ' HB1' ' HB3' ' A' ' 479' ' ' GLU . . . -61.56 156.54 19.41 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.146 0.498 . . . . 61.34 111.821 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -81.25 133.6 35.47 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.344 -0.844 . . . . 74.42 109.878 -178.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.518 ' HB ' HD11 ' A' ' 527' ' ' LEU . 26.8 m -137.36 175.53 9.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.892 0.377 . . . . 74.04 110.858 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . 0.547 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 55.9 tttp -151.31 122.63 7.8 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.306 -0.627 . . . . 74.25 109.306 -177.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -101.92 120.1 39.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.858 0.361 . . . . 72.2 111.143 -176.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . 0.493 HD22 ' HE3' ' A' ' 485' ' ' LYS . 98.0 mt -120.45 135.51 55.03 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.911 -0.586 . . . . 73.15 110.411 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.648 ' HZ2' ' HA ' ' A' ' 521' ' ' ASP . 5.2 tmmm? -111.88 104.77 13.09 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.572 -0.899 . . . . 74.34 108.572 174.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.31 36.66 16.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.598 -0.728 . . . . 65.32 110.877 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.08 -14.11 61.53 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.833 -0.698 . . . . 64.41 113.266 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 39.9 t -100.76 123.2 53.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 122.47 -0.429 . . . . 71.42 110.43 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -71.77 135.69 46.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.98 0.419 . . . . 74.13 110.78 -179.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 91.1 mt -78.42 128.26 33.36 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.953 -0.567 . . . . 74.01 110.125 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 11.8 t -80.88 138.9 36.17 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.13 0.49 . . . . 75.02 110.036 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . 0.597 ' HA ' HG23 ' A' ' 498' ' ' THR . 0.0 OUTLIER -126.02 14.24 7.9 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.834 -0.621 . . . . 73.45 110.043 -178.01 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -70.49 -34.22 72.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.478 0.656 . . . . 65.43 109.304 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -144.69 107.21 4.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.014 -0.994 . . . . 75.12 109.014 173.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' THR . . . . . 0.597 HG23 ' HA ' ' A' ' 495' ' ' ARG . 22.6 p -120.21 114.87 22.56 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.221 -0.445 . . . . 73.12 111.205 -176.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -111.82 -18.97 12.58 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.045 0.45 . . . . 75.33 111.039 170.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -99.38 -42.84 6.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.06 -0.518 . . . . 71.52 111.136 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.478 ' O ' ' HB ' ' A' ' 498' ' ' THR . 46.4 m-85 -107.64 138.54 43.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.368 -0.378 . . . . 74.31 110.611 -176.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' ARG . . . . . 0.503 ' HB2' ' CG2' ' A' ' 513' ' ' ILE . 0.8 OUTLIER -118.34 123.95 46.58 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.704 0.288 . . . . 73.3 110.418 175.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . 0.422 ' CE2' HD11 ' A' ' 512' ' ' LEU . 89.5 m-85 -103.1 112.84 25.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.743 -0.662 . . . . 72.23 109.615 178.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.479 ' HE2' HG21 ' A' ' 513' ' ' ILE . 0.0 OUTLIER -113.79 135.82 53.54 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.978 0.418 . . . . 71.13 111.005 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.504 ' HD3' ' HA2' ' A' ' 481' ' ' GLY . 20.4 ttmt -115.15 111.89 21.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.537 -0.756 . . . . 70.4 109.699 177.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -119.58 88.17 2.88 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.542 -0.54 . . . . 73.12 109.542 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.65 -106.45 1.76 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.611 -0.805 . . . . 70.22 112.107 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -101.54 -15.9 16.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.582 0.229 . . . . 65.44 110.701 -177.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.41 ' HA ' ' HA ' ' A' ' 476' ' ' GLU . 26.6 ptt180 -89.76 151.54 21.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.196 0.522 . . . . 74.24 110.219 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 -132.06 136.35 47.14 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.012 -0.736 . . . . 73.03 109.012 175.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -123.9 124.09 41.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.008 0.432 . . . . 73.05 111.473 177.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.465 HD13 ' HB3' ' A' ' 501' ' ' TYR . 53.1 tp -105.46 102.72 12.17 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.19 -1.041 . . . . 74.34 108.19 169.013 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.503 ' CG2' ' HB2' ' A' ' 502' ' ' ARG . 8.0 tp -98.68 113.2 32.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.668 0.746 . . . . 73.5 109.8 -179.099 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.461 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 60.5 mt -88.6 115.96 29.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.309 -0.86 . . . . 73.45 109.365 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -63.81 -45.37 89.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.882 0.372 . . . . 73.21 111.056 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -141.83 110.91 6.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.95 -0.568 . . . . 73.13 110.074 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -83.29 137.14 34.11 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.09 -0.505 . . . . 73.33 110.953 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' MET . . . . . 0.59 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 26.3 mmt -107.72 170.78 7.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.919 -0.582 . . . . 72.25 110.086 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -64.07 -54.68 30.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.178 0.513 . . . . 73.31 110.808 -173.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -82.77 -4.84 58.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.645 -0.707 . . . . 74.34 111.089 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . 0.648 ' HA ' ' HZ2' ' A' ' 488' ' ' LYS . 1.0 OUTLIER -89.3 -7.49 55.28 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.081 -0.508 . . . . 74.44 111.509 -178.496 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.473 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -74.4 -43.72 55.16 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.76 -0.376 . . . . 53.25 111.371 -177.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 41.41 -158.11 0.04 OUTLIER Glycine 0 CA--C 1.526 0.767 0 CA-C-O 121.95 0.75 . . . . 73.12 114.845 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -111.51 113.79 26.45 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.07 -0.715 . . . . 75.03 109.07 169.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . 0.578 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 60.6 m-85 -84.35 130.95 34.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.083 0.468 . . . . 72.43 110.207 -178.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -137.87 119.65 15.21 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.657 -0.701 . . . . 72.11 110.276 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.518 HD11 ' HB ' ' A' ' 484' ' ' VAL . 33.7 tp -89.78 109.59 20.57 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.255 -0.646 . . . . 73.21 109.255 178.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . 0.547 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 60.3 m -94.83 113.97 25.78 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.302 0.572 . . . . 75.13 110.24 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.553 ' C ' ' H ' ' A' ' 531' ' ' GLY . 55.8 p -116.13 -165.92 1.09 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.408 -0.815 . . . . 75.53 110.973 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 530' ' ' SER . . . . . 0.53 ' HB2' ' HB ' ' A' ' 454' ' ' VAL . 33.1 m -52.87 5.05 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.451 1.1 . . . . 63.15 113.729 172.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . 0.553 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.79 27.44 1.91 Allowed Glycine 0 C--N 1.33 0.224 0 O-C-N 122.018 -0.426 . . . . 75.15 113.357 -177.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -111.75 134.58 12.18 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 109.658 -1.377 . . . . 73.3 109.658 164.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -119.09 120.54 37.45 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 117.193 0.496 . . . . 62.0 111.685 -172.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -121.3 143.3 49.25 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.799 -0.815 . . . . 60.31 108.799 171.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.434 HD11 ' N ' ' A' ' 536' ' ' ALA . 2.4 tm? -128.54 133.56 48.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.001 0.429 . . . . 65.03 110.384 -174.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.585 ' HB3' ' HB3' ' A' ' 460' ' ' LEU . . . -127.65 131.11 49.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.915 -0.584 . . . . 73.42 110.272 176.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -113.49 115.7 28.43 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.19 -0.671 . . . . 75.55 109.19 176.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.446 HD12 HG23 ' A' ' 465' ' ' VAL . 37.6 tp -109.46 134.61 51.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.991 -0.55 . . . . 73.02 110.349 -173.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.505 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 43.1 mt -119.86 113.69 41.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.375 -0.602 . . . . 75.21 109.375 175.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.504 HG22 HG22 ' A' ' 465' ' ' VAL . 85.7 t -103.89 134.66 44.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.831 -0.433 . . . . 72.44 109.831 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.36 146.07 49.58 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.295 -0.411 . . . . 74.05 110.057 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -83.4 109.31 17.21 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.939 -0.763 . . . . 75.32 108.939 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.764 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 10.9 mmpt? . . . . . 0 C--O 1.245 0.846 0 CA-C-O 118.306 -0.854 . . . . 73.22 109.753 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.764 0 N-CA-C 112.384 -0.286 . . . . 64.14 112.384 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 40.0 m -114.89 84.26 2.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.914 0.387 . . . . 71.52 110.409 176.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.85 41.41 0.29 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.201 0.524 . . . . 73.23 110.567 177.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 51.9 mtm -114.75 107.32 50.78 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.71 -0.677 . . . . 64.15 109.927 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -64.28 133.88 39.69 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 121.859 1.706 . . . . 72.42 110.04 172.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.414 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 92.2 t -64.36 107.6 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.37 0.605 . . . . 72.44 110.213 -176.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 44.1 tp -106.14 162.38 13.68 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.165 -0.925 . . . . 74.21 109.465 -177.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 34.1 mt -104.58 107.54 22.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 110.041 -0.355 . . . . 74.24 110.041 -177.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' THR . . . . . 0.492 ' O ' ' HD3' ' A' ' 459' ' ' PRO . 21.4 p -80.57 -44.01 19.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.316 0.579 . . . . 72.33 110.367 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.449 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 8.1 tpt85 -99.79 101.63 14.48 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 115.383 -0.826 . . . . 72.24 109.18 175.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . 0.492 ' HD3' ' O ' ' A' ' 457' ' ' THR . 17.0 Cg_exo -67.36 165.18 27.83 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.726 2.284 . . . . 71.42 111.493 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.685 ' HB2' ' HB1' ' A' ' 536' ' ' ALA . 3.2 mm? -65.86 166.45 11.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.357 -0.383 . . . . 75.44 110.395 -179.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . 0.41 ' OE1' ' HA ' ' A' ' 461' ' ' GLU . 1.4 tp10 -69.87 157.17 37.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.481 0.657 . . . . 75.42 112.255 -172.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -105.49 7.67 33.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.883 -1.053 . . . . 74.12 113.649 -168.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -123.41 153.63 40.14 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.162 -1.015 . . . . 74.11 112.423 -167.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.649 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 1.8 pt? -108.75 145.47 35.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.177 -1.374 . . . . 72.33 110.89 -171.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.553 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 27.5 m -124.19 176.83 5.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.078 0.466 . . . . 73.44 111.21 -178.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -100.14 166.7 10.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.786 -0.643 . . . . 65.32 110.358 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . 0.404 HG21 ' HG2' ' A' ' 542' ' ' GLU . 24.5 t -60.03 138.25 21.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.329 -0.396 . . . . 73.43 111.254 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 82.18 -4.05 78.25 Favored Glycine 0 C--N 1.329 0.185 0 C-N-CA 121.192 -0.528 . . . . 71.01 112.809 176.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -102.46 143.32 32.34 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.181 -0.303 . . . . 75.44 110.181 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . 0.521 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 1.1 ptp180 -72.02 147.98 46.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.269 -0.423 . . . . 72.13 110.885 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.483 ' HB ' HG23 ' A' ' 465' ' ' VAL . 7.5 p -140.91 133.71 31.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.999 -0.546 . . . . 74.34 109.684 174.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.556 ' HG2' HD12 ' A' ' 513' ' ' ILE . 44.3 mt-10 -100.95 132.48 46.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.017 0.437 . . . . 71.55 110.968 -178.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.532 ' HB3' HD11 ' A' ' 460' ' ' LEU . 80.6 m-85 -124.09 112.28 16.94 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.042 -0.725 . . . . 74.01 109.042 169.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -118.52 138.65 52.38 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.102 0.477 . . . . 60.43 110.619 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.441 ' HB3' HD13 ' A' ' 460' ' ' LEU . 7.4 p -138.91 146.38 41.0 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.628 -0.714 . . . . 70.44 110.518 -178.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.585 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 44.3 mt-10 -116.38 138.08 51.64 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.213 -0.448 . . . . 75.2 109.821 176.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 479' ' ' GLU . 14.2 m -119.27 164.83 15.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.86 -0.609 . . . . 74.13 110.874 -179.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 7.9 m -66.19 -12.87 58.75 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.723 0.638 . . . . 62.14 112.723 -174.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . 0.532 ' HB3' ' HB3' ' A' ' 482' ' ' ALA . 40.8 tt0 -129.33 145.23 51.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.733 0.301 . . . . 75.13 110.847 -176.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . 0.441 ' H ' ' CD ' ' A' ' 480' ' ' GLU . 0.6 OUTLIER -79.69 126.95 31.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.188 -0.46 . . . . 72.12 110.541 -179.317 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 64.0 25.86 69.75 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.962 -0.637 . . . . 62.22 112.049 -176.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.532 ' HB3' ' HB3' ' A' ' 479' ' ' GLU . . . -58.44 152.9 16.92 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.148 0.499 . . . . 75.44 112.129 -177.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -76.32 111.95 12.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.26 -0.882 . . . . 73.44 109.875 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.537 ' HB ' HD12 ' A' ' 527' ' ' LEU . 35.2 m -124.98 150.72 30.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.172 -0.467 . . . . 64.15 111.077 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 528' ' ' CYS . 45.4 tttp -121.86 129.72 52.81 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.177 -0.675 . . . . 74.01 109.177 179.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -101.17 126.84 47.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.644 0.259 . . . . 73.51 110.477 -178.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . 0.432 HD13 ' HD3' ' A' ' 485' ' ' LYS . 5.1 mp -131.44 150.96 51.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.355 0.598 . . . . 62.21 111.194 -179.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.566 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 5.8 tmmm? -129.6 107.78 9.71 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.95 -1.023 . . . . 73.31 108.517 173.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.93 35.28 26.16 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.036 -0.529 . . . . 74.24 111.328 -176.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 95.96 -20.91 47.85 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.952 -0.642 . . . . 75.21 112.735 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 62.1 t -85.02 122.84 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 110.225 -0.287 . . . . 74.55 110.225 -177.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -69.06 132.18 46.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.344 -0.389 . . . . 75.41 110.651 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 79.9 mt -87.11 104.72 16.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.83 -0.623 . . . . 62.55 110.07 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 9.7 t -69.64 160.94 30.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.304 0.573 . . . . 63.42 111.206 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . 0.606 ' HA ' HG21 ' A' ' 498' ' ' THR . 0.0 OUTLIER -117.84 -3.45 11.21 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.624 -0.717 . . . . 75.3 109.5 179.689 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -60.82 -39.18 88.01 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.253 -0.885 . . . . 65.14 110.397 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . 0.418 ' O ' ' HG3' ' A' ' 497' ' ' GLU . 8.1 pt-20 -127.55 108.26 10.64 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.101 -0.704 . . . . 72.45 109.101 167.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' THR . . . . . 0.606 HG21 ' HA ' ' A' ' 495' ' ' ARG . 0.7 OUTLIER -122.29 88.0 2.85 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.389 0.614 . . . . 74.04 111.235 -176.593 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -100.91 -27.4 13.33 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.42 -0.809 . . . . 64.44 109.078 175.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -95.43 -47.32 6.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.208 -0.906 . . . . 74.43 111.026 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.444 ' O ' ' HD2' ' A' ' 502' ' ' ARG . 13.8 m-85 -103.21 148.41 25.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.2 -0.455 . . . . 74.31 110.622 -176.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' ARG . . . . . 0.444 ' HD2' ' O ' ' A' ' 501' ' ' TYR . 1.5 mpt_? -132.58 137.69 47.17 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.558 -0.534 . . . . 75.33 109.558 171.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -111.94 118.55 35.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.654 0.264 . . . . 72.35 110.799 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 1.4 mptm? -111.83 145.37 39.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.68 0.276 . . . . 72.13 110.354 176.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -123.35 117.57 25.52 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.318 -0.401 . . . . 74.43 110.787 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . 0.442 ' HB2' ' HG3' ' A' ' 509' ' ' ARG . 42.2 m-20 -121.27 77.7 1.35 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.631 -0.507 . . . . 73.23 109.631 173.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 64.84 -109.26 2.75 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.648 -0.786 . . . . 43.41 112.034 -178.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -85.91 -24.66 26.52 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.769 -0.254 . . . . 74.54 111.091 -177.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.585 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 29.6 ptt180 -92.95 132.41 37.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.616 0.722 . . . . 54.21 110.93 -177.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -114.94 143.98 44.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.519 -0.764 . . . . 73.53 109.28 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . 0.517 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 25.6 m-70 -119.22 127.62 53.44 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.844 -0.343 . . . . 71.14 110.803 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.403 HD13 ' HB3' ' A' ' 501' ' ' TYR . 65.4 tp -107.03 102.94 12.25 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.363 -0.977 . . . . 71.24 108.363 168.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.556 HD12 ' HG2' ' A' ' 472' ' ' GLU . 5.8 tp -103.47 115.46 45.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.518 0.675 . . . . 63.2 110.242 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.521 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 34.0 mt -95.27 112.74 28.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.631 -0.713 . . . . 71.32 109.221 177.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -73.76 -43.12 59.97 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.076 0.465 . . . . 73.34 110.048 -176.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -128.67 108.54 10.57 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.548 -0.751 . . . . 73.21 109.519 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -91.48 138.23 31.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.109 -0.496 . . . . 55.14 110.25 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 26.5 mmt -118.84 175.18 5.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.203 -0.453 . . . . 71.3 110.012 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -64.99 -53.91 38.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.34 -0.391 . . . . 74.53 111.089 -173.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -80.01 -18.5 50.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.128 0.49 . . . . 73.11 110.716 -178.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.29 -33.34 71.45 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.048 -0.524 . . . . 64.25 111.755 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.439 ' HB1' ' CG2' ' A' ' 540' ' ' VAL . . . -64.4 -44.5 91.08 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.865 0.32 . . . . 71.42 111.865 -175.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . 0.566 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 40.47 -157.55 0.03 OUTLIER Glycine 0 CA--C 1.525 0.673 0 O-C-N 123.911 0.757 . . . . 43.22 114.818 175.032 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 53.7 m80 -105.88 112.45 25.51 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.471 -0.937 . . . . 72.42 108.471 169.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -85.45 131.45 34.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.259 0.552 . . . . 72.44 111.262 -175.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.28 131.42 34.4 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.301 -0.863 . . . . 75.12 110.558 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.537 HD12 ' HB ' ' A' ' 484' ' ' VAL . 37.3 tp -99.62 115.16 28.77 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.438 -0.578 . . . . 74.32 109.438 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 485' ' ' LYS . 48.4 t -100.16 112.87 25.2 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.702 -0.481 . . . . 74.33 109.702 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.567 ' C ' ' H ' ' A' ' 531' ' ' GLY . 61.2 p -111.51 -165.0 0.95 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.886 -0.597 . . . . 73.34 110.625 -178.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 11.9 m -51.09 6.06 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.611 1.164 . . . . 73.5 113.961 171.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . 0.567 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.42 28.88 1.54 Allowed Glycine 0 C--N 1.332 0.348 0 O-C-N 121.952 -0.467 . . . . 64.54 113.253 -175.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -113.4 141.76 17.1 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 109.974 -1.25 . . . . 74.32 109.974 167.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.4 tp60 -128.84 121.96 29.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.461 0.63 . . . . 63.11 112.096 -173.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -131.14 132.16 44.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.581 -0.736 . . . . 55.13 109.274 170.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -118.81 124.38 47.05 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.032 -0.358 . . . . 75.25 110.032 -176.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.685 ' HB1' ' HB2' ' A' ' 460' ' ' LEU . . . -118.69 159.13 24.2 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.136 -0.484 . . . . 74.53 110.215 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -127.36 123.12 35.51 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.92 0.391 . . . . 75.24 110.815 -176.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.519 HD11 ' HA ' ' A' ' 464' ' ' LEU . 54.8 tp -112.12 121.48 45.08 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.878 -0.601 . . . . 75.22 109.723 176.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.649 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.5 mp -108.26 107.66 23.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 109.016 -0.735 . . . . 74.54 109.016 176.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.553 ' HA ' ' O ' ' A' ' 465' ' ' VAL . 42.2 t -94.79 122.82 46.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.32 0.581 . . . . 74.32 110.37 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . 0.449 ' HB3' ' HE3' ' A' ' 543' ' ' LYS . 7.5 mt-30 -114.64 160.54 19.21 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.98 -1.009 . . . . 74.31 110.166 -176.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . 0.404 ' HG2' HG21 ' A' ' 467' ' ' VAL . 46.6 mt-10 -105.95 106.76 17.42 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.949 -0.76 . . . . 64.44 108.949 174.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.449 ' HE3' ' HB3' ' A' ' 541' ' ' GLN . 17.2 ptpt . . . . . 0 C--O 1.245 0.854 0 CA-C-N 116.293 -0.412 . . . . 55.53 110.137 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.781 0 N-CA-C 111.918 -0.473 . . . . 53.41 111.918 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 5.7 m -111.15 148.16 33.35 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.617 -0.512 . . . . 73.41 109.617 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 -65.05 119.96 11.76 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.059 -0.719 . . . . 65.24 109.059 173.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 21.6 ptm -69.55 138.35 88.62 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 116.181 -0.463 . . . . 74.41 111.166 -174.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.83 132.9 22.49 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.21 1.94 . . . . 74.41 109.656 168.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.531 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 55.1 t -68.52 106.69 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 120.889 0.376 . . . . 61.51 110.158 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 52.6 tp -87.64 138.75 31.2 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.943 -0.571 . . . . 74.3 110.348 -178.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . 0.43 HD12 HD22 ' A' ' 527' ' ' LEU . 32.7 mt -91.75 113.3 26.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.563 -0.744 . . . . 75.05 109.458 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' THR . . . . . 0.434 ' OG1' ' HB2' ' A' ' 476' ' ' GLU . 28.6 p -77.29 -45.86 24.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.929 0.395 . . . . 74.03 110.808 -176.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.401 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 12.1 tpt180 -92.1 111.03 48.09 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.994 -0.548 . . . . 71.12 109.857 176.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -68.81 149.67 73.01 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.491 2.127 . . . . 65.14 111.109 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.723 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 4.0 mm? -66.2 158.94 27.51 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.316 -0.402 . . . . 75.42 110.792 -178.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . 0.518 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 1.8 mp0 -65.12 144.41 57.25 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.97 0.891 . . . . 61.13 112.709 -172.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -104.77 9.13 35.07 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.049 -1.432 . . . . 74.33 111.729 -174.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . 0.493 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -121.44 154.36 36.65 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 122.214 1.006 . . . . 73.41 112.894 -160.256 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -90.86 147.08 23.41 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 113.4 -1.727 . . . . 75.44 112.206 -167.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.517 HG12 ' HB ' ' A' ' 471' ' ' VAL . 27.4 m -126.68 178.0 4.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.45 -0.795 . . . . 71.42 110.076 175.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 51.4 mtm -118.16 158.65 24.69 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.245 -0.434 . . . . 64.25 110.82 -178.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 51.4 t -50.95 128.6 8.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.653 -0.703 . . . . 72.31 111.72 -176.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 89.39 -16.04 57.06 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 115.838 -0.619 . . . . 72.14 113.337 174.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -83.17 135.09 34.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 117.038 0.419 . . . . 74.55 110.792 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . 0.527 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 2.0 ptm180 -66.33 126.52 29.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.63 -0.714 . . . . 74.31 110.61 175.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.517 ' HB ' HG12 ' A' ' 465' ' ' VAL . 5.2 p -113.16 137.94 44.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.749 -0.463 . . . . 72.34 109.749 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.454 ' HB2' ' NH2' ' A' ' 470' ' ' ARG . 30.4 tt0 -120.49 124.02 44.39 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.785 -0.643 . . . . 72.32 110.515 -173.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.518 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 97.4 m-85 -110.28 141.07 43.78 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.905 -0.589 . . . . 71.52 109.557 176.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -119.2 134.97 54.9 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.903 0.382 . . . . 73.01 110.234 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 27.1 p -146.93 126.55 13.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.368 -0.378 . . . . 61.22 110.392 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.434 ' HB2' ' OG1' ' A' ' 457' ' ' THR . 31.4 mt-10 -110.77 137.66 48.14 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.82 -0.807 . . . . 75.03 108.82 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.563 HG22 ' O ' ' A' ' 508' ' ' GLN . 27.8 m -119.48 152.63 22.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 C-N-CA 120.562 -0.455 . . . . 71.43 110.653 177.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 16.1 m -66.68 -26.04 66.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.66 -0.7 . . . . 63.22 111.718 -175.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . 0.415 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 37.8 tt0 -106.42 118.18 35.98 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.865 -0.42 . . . . 70.53 109.865 -178.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . 0.794 ' HB3' ' HG2' ' A' ' 508' ' ' GLN . 10.0 pt-20 -76.19 134.34 39.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.093 0.473 . . . . 73.45 110.893 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 72.68 21.18 79.78 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.696 -0.684 . . . . 63.5 112.092 -176.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.415 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -73.28 150.84 41.64 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.88 0.372 . . . . 74.3 111.452 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -81.72 114.53 20.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.551 -0.75 . . . . 71.1 110.438 178.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.502 HG12 HG23 ' A' ' 529' ' ' THR . 21.2 m -125.84 150.64 31.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 70.45 109.862 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . 0.477 ' HE2' HD11 ' A' ' 487' ' ' LEU . 21.0 ptmt -125.61 140.44 52.73 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.065 0.459 . . . . 74.23 110.749 177.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -102.01 125.78 48.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.621 -0.718 . . . . 73.05 110.222 -179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . 0.477 HD11 ' HE2' ' A' ' 485' ' ' LYS . 5.7 mp -114.13 136.4 52.98 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.063 -0.517 . . . . 71.31 110.379 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.15 105.46 12.62 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.813 -1.181 . . . . 72.14 107.813 174.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 57.12 34.04 24.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.993 -0.549 . . . . 73.31 110.691 -174.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.25 -18.88 56.65 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.001 -0.619 . . . . 62.15 112.906 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 45.5 t -83.09 127.45 39.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 110.328 -0.249 . . . . 71.33 110.328 -178.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -72.24 126.56 30.12 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.47 -0.567 . . . . 73.41 109.47 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.474 HD11 ' HE2' ' A' ' 525' ' ' TYR . 77.3 mt -66.04 106.43 1.61 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.141 0.496 . . . . 74.22 110.641 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 9.8 t -73.45 141.52 46.87 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 115.586 -0.734 . . . . 74.25 110.751 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . 0.471 ' N ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -107.7 13.12 26.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.694 -0.685 . . . . 74.33 110.264 -179.04 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -59.96 -56.61 19.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.8 -0.637 . . . . 60.34 109.644 174.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -137.78 118.39 13.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.729 -0.668 . . . . 75.4 109.913 173.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.2 108.56 5.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.076 -0.511 . . . . 74.01 110.42 -178.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -104.47 -22.22 13.33 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.284 0.564 . . . . 74.23 110.098 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -92.87 -34.47 13.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.744 -0.662 . . . . 73.51 111.611 -177.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.402 ' HD1' HG12 ' A' ' 514' ' ' ILE . 8.0 m-85 -115.77 141.51 48.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.617 -0.265 . . . . 73.03 110.309 -174.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -132.52 126.42 32.86 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.87 0.366 . . . . 74.21 110.128 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -96.43 113.63 25.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.803 -0.635 . . . . 73.21 110.819 -174.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 42.1 mttm -109.64 124.41 51.13 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.101 -0.5 . . . . 63.51 111.246 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -103.92 111.15 23.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.022 -0.535 . . . . 75.31 109.984 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -120.03 87.09 2.68 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.124 0.488 . . . . 74.41 110.2 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 63.4 -105.51 1.08 Allowed Glycine 0 N--CA 1.449 -0.448 0 CA-C-N 115.638 -0.71 . . . . 71.42 112.843 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . 0.794 ' HG2' ' HB3' ' A' ' 480' ' ' GLU . 18.5 mt-30 -93.1 -25.18 18.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.767 0.318 . . . . 74.42 110.871 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -96.43 153.4 17.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.352 0.596 . . . . 73.25 111.002 -175.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -127.1 123.06 35.98 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.72 -0.673 . . . . 71.33 109.268 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . 0.539 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 56.3 m-70 -101.52 118.3 36.67 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.989 -0.374 . . . . 72.1 109.989 -177.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 61.5 tp -104.29 106.69 17.28 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.265 -0.642 . . . . 74.43 109.265 173.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 9.2 tp -104.92 128.77 58.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.992 -0.549 . . . . 75.14 110.133 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.527 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 34.2 mt -104.54 114.3 43.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.204 -0.665 . . . . 61.13 109.204 175.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -58.23 -52.64 64.74 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.547 0.529 . . . . 44.51 111.435 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -137.74 109.64 7.17 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.722 -0.473 . . . . 73.35 109.722 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -76.19 127.38 32.8 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.953 -0.567 . . . . 74.01 111.238 -178.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' MET . . . . . 0.694 ' HA ' ' HE2' ' A' ' 518' ' ' MET . 14.9 mmt -97.51 175.43 6.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.836 -0.62 . . . . 72.35 109.678 176.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.2 -53.36 25.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.952 0.406 . . . . 72.35 110.805 -178.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -71.32 -27.89 63.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.072 -0.513 . . . . 73.11 111.034 -177.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -77.83 -3.44 41.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.516 -0.766 . . . . 72.5 111.857 -173.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.52 ' HA ' HD21 ' A' ' 538' ' ' LEU . . . -74.37 -43.2 57.54 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.498 -0.481 . . . . 62.22 109.918 177.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 38.28 -158.55 0.01 OUTLIER Glycine 0 C--N 1.339 0.734 0 O-C-N 124.457 1.098 . . . . 44.3 115.557 172.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -114.05 108.86 17.57 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.307 -0.627 . . . . 74.22 109.307 169.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . 0.474 ' HE2' HD11 ' A' ' 493' ' ' LEU . 32.1 m-85 -85.63 133.86 34.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.964 0.411 . . . . 73.41 111.087 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -134.35 128.78 34.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.924 -0.58 . . . . 64.44 110.545 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.482 HD11 ' HB ' ' A' ' 484' ' ' VAL . 63.4 tp -99.86 111.98 24.27 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.84 -0.43 . . . . 73.52 109.84 176.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 70.8 m -104.79 126.08 51.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.299 0.571 . . . . 60.01 110.914 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.581 ' C ' ' H ' ' A' ' 531' ' ' GLY . 30.1 p -115.79 -165.52 1.05 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.341 -0.845 . . . . 72.41 110.119 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 530' ' ' SER . . . . . 0.405 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 14.7 m -50.77 7.43 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.859 1.264 . . . . 73.32 114.173 171.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . 0.581 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 122.14 28.18 1.55 Allowed Glycine 0 C--N 1.331 0.266 0 O-C-N 122.007 -0.433 . . . . 62.54 113.245 -174.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -117.76 138.37 13.96 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.603 -1.399 . . . . 51.13 109.603 163.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -129.35 127.92 42.04 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 117.463 0.632 . . . . 73.31 112.103 -171.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -136.62 136.45 39.18 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.485 -0.78 . . . . 74.11 109.551 171.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 33.3 tp -109.09 145.24 36.0 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.817 0.341 . . . . 62.21 111.029 -176.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.723 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -123.72 132.46 53.82 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.092 -0.504 . . . . 72.24 110.324 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -110.41 115.92 30.51 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.77 -0.456 . . . . 71.34 109.77 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.52 HD21 ' HA ' ' A' ' 522' ' ' ALA . 35.7 tp -108.64 121.07 44.25 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.058 -0.519 . . . . 75.11 109.723 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 4.5 mp -109.98 116.64 52.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.228 -0.656 . . . . 73.13 109.228 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.503 HG23 HG23 ' A' ' 465' ' ' VAL . 90.1 t -114.1 128.44 71.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.92 0.391 . . . . 75.23 110.257 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.46 169.65 14.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.048 -0.524 . . . . 64.33 109.894 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.53 141.31 39.67 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.532 -0.758 . . . . 72.32 110.642 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.454 ' HE3' ' HB2' ' A' ' 543' ' ' LYS . 33.2 mtmt . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.398 -0.811 . . . . 72.2 110.033 176.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.621 0 N-CA-C 111.818 -0.513 . . . . 60.04 111.818 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 21.5 p -135.25 142.89 46.03 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 110.188 -0.301 . . . . 73.34 110.188 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -79.8 111.98 16.64 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.785 -0.45 . . . . 75.23 109.785 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' MET . . . . . 0.444 ' HA ' ' HD3' ' A' ' 453' ' ' PRO . 23.6 ptm -66.05 126.88 92.69 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.928 -0.578 . . . . 74.32 111.394 -176.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 452' ' ' MET . 1.4 Cg_endo -84.76 159.77 12.13 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 C-N-CA 122.798 2.332 . . . . 73.11 110.391 170.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.553 ' HB ' ' HB ' ' A' ' 529' ' ' THR . 58.5 t -78.18 107.35 10.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 108.979 -0.749 . . . . 73.04 108.979 178.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . 0.434 ' O ' ' HA ' ' A' ' 477' ' ' VAL . 62.0 tp -84.91 124.17 31.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.733 -0.667 . . . . 75.0 110.753 -173.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . 0.492 HD12 HD22 ' A' ' 527' ' ' LEU . 29.3 mt -91.01 98.9 8.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.71 -0.677 . . . . 72.42 109.998 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 33.8 p -79.19 -16.04 57.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 72.44 111.088 -176.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . . . . . . . . . 19.2 tpt85 -130.38 102.03 17.21 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.904 -0.589 . . . . 75.14 109.717 177.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -63.62 167.73 12.89 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 123.224 2.616 . . . . 74.4 112.078 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.78 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 3.2 mm? -71.1 172.59 8.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.077 -0.51 . . . . 73.41 110.906 -177.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . 0.878 ' HG2' ' HA ' ' A' ' 473' ' ' PHE . 13.5 mm-40 -67.78 152.8 45.0 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.787 -0.642 . . . . 72.24 112.488 -176.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -105.53 6.51 32.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.315 -0.857 . . . . 70.43 112.454 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -123.7 154.53 39.29 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.89 0.852 . . . . 71.44 113.008 -162.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.645 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.0 pt? -103.9 146.84 28.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.185 -1.37 . . . . 74.52 111.808 -170.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.529 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 27.5 m -123.71 178.87 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-O 121.079 0.466 . . . . 75.12 111.265 -177.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 10.4 mtm -112.32 161.61 16.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.377 -0.374 . . . . 72.24 111.295 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . 0.45 HG23 ' HG2' ' A' ' 542' ' ' GLU . 59.6 t -56.72 129.67 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 115.955 -0.566 . . . . 52.35 112.178 -176.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 86.12 7.7 79.86 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.72 -0.673 . . . . 75.41 113.208 174.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -116.73 133.01 56.53 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.799 0.299 . . . . 72.41 110.306 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . 0.578 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 5.3 ptm180 -74.02 131.86 41.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.301 0.572 . . . . 72.5 112.1 -175.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.528 ' HB ' HG12 ' A' ' 465' ' ' VAL . 7.5 p -115.37 146.33 19.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.205 -0.907 . . . . 71.55 109.714 176.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -123.03 129.17 51.16 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.381 -0.229 . . . . 75.12 110.381 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.878 ' HA ' ' HG2' ' A' ' 461' ' ' GLU . 96.0 m-85 -106.45 124.89 50.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.437 -0.579 . . . . 74.45 109.437 174.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -100.25 131.48 46.16 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.085 -0.339 . . . . 74.03 110.085 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 18.2 p -141.4 118.05 10.98 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.091 0.472 . . . . 45.42 110.555 177.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.63 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 39.7 mt-10 -107.39 138.58 43.33 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.853 -0.612 . . . . 71.42 109.747 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.434 ' HA ' ' O ' ' A' ' 455' ' ' LEU . 28.2 m -132.57 174.06 13.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.297 -0.411 . . . . 71.12 110.767 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 16.7 p -85.77 8.37 20.2 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.482 0.549 . . . . 74.3 112.482 -175.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . 0.559 ' OE1' ' HA ' ' A' ' 482' ' ' ALA . 41.2 tt0 -126.82 134.83 50.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.6 0.238 . . . . 75.23 110.631 -177.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . 0.51 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 0.4 OUTLIER -81.83 128.27 33.85 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.555 -0.535 . . . . 73.23 109.555 179.15 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 60.27 32.79 77.89 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.165 -1.017 . . . . 62.55 110.879 -171.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.559 ' HA ' ' OE1' ' A' ' 479' ' ' GLU . . . -50.71 141.67 12.5 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 113.145 0.794 . . . . 75.51 113.145 -174.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -74.79 103.7 5.14 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.126 -0.943 . . . . 75.5 109.813 175.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.511 ' HB ' HD11 ' A' ' 527' ' ' LEU . 34.3 m -121.51 150.11 24.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.931 -0.577 . . . . 73.22 110.836 -177.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 47.1 tttp -123.27 126.86 47.7 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.213 -0.662 . . . . 73.21 109.213 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . 0.458 ' HB3' HD13 ' A' ' 493' ' ' LEU . 95.3 m95 -101.39 125.29 48.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.605 -0.27 . . . . 74.35 110.638 -177.475 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . 0.424 HD11 ' SG ' ' A' ' 528' ' ' CYS . 6.5 mp -128.12 144.07 51.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.065 0.459 . . . . 75.41 110.77 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.467 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 5.8 tmmm? -124.19 106.78 10.58 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.363 -0.977 . . . . 74.13 108.363 174.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 52.21 36.01 18.23 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.749 0.656 . . . . 73.24 111.693 -175.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.02 -20.07 51.73 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.869 -0.681 . . . . 64.33 112.921 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 43.4 t -86.64 123.79 39.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 110.092 -0.336 . . . . 63.44 110.092 -179.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -70.6 134.28 47.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.094 0.473 . . . . 74.41 110.804 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.458 HD13 ' HB3' ' A' ' 486' ' ' TRP . 52.2 mt -82.73 103.22 12.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.767 -0.651 . . . . 75.53 109.411 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 7.0 t -65.15 145.52 56.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 73.1 111.631 -177.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.62 9.5 17.88 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.149 -0.932 . . . . 75.15 109.482 176.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.32 -44.41 16.24 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.723 -0.671 . . . . 74.54 110.04 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' A' ' 497' ' ' GLU . 7.0 pt-20 -143.16 110.08 5.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.314 0.578 . . . . 73.33 109.573 171.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' THR . . . . . 0.515 HG23 ' HB2' ' A' ' 501' ' ' TYR . 0.3 OUTLIER -142.76 109.54 5.47 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.231 0.539 . . . . 71.25 111.381 -177.072 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -89.88 -7.54 53.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.616 -0.72 . . . . 72.23 110.871 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . 0.416 ' CG ' ' HB2' ' A' ' 516' ' ' GLU . 3.4 mtmm -114.4 -48.75 2.86 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.048 -0.524 . . . . 64.44 112.054 -173.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.515 ' HB2' HG23 ' A' ' 498' ' ' THR . 57.2 m-85 -93.04 126.77 38.29 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.813 -0.44 . . . . 75.5 109.813 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' ARG . . . . . 0.439 ' HD2' ' HA ' ' A' ' 502' ' ' ARG . 1.2 tpt180 -117.09 123.11 45.99 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.234 -0.654 . . . . 74.43 109.234 177.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -104.13 117.46 34.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.236 -0.438 . . . . 71.12 110.228 -174.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 57.2 mttm -114.35 131.56 56.51 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.35 -0.386 . . . . 73.11 110.576 -178.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -103.9 118.27 36.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.196 -0.456 . . . . 73.14 110.687 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -120.42 89.92 3.22 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.104 -0.498 . . . . 64.52 110.016 174.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 61.68 -101.45 0.35 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.637 -0.71 . . . . 74.52 112.518 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . 0.51 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 26.5 mt-30 -98.88 -20.23 16.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.524 0.202 . . . . 75.44 111.376 -177.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.63 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 14.7 ptt180 -101.04 153.54 19.46 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.333 0.587 . . . . 73.45 111.585 -175.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -121.99 141.37 51.41 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.424 -0.807 . . . . 75.53 109.494 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 15.3 m-70 -110.6 133.26 53.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 110.02 -0.363 . . . . 75.43 110.02 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.517 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 66.6 tp -107.51 104.19 13.69 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.739 -0.467 . . . . 64.32 109.739 172.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.478 HD12 ' HD2' ' A' ' 504' ' ' LYS . 1.9 mp -100.91 127.7 53.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.065 -0.516 . . . . 53.33 110.092 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.578 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 53.7 mt -108.1 112.37 39.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.743 -0.466 . . . . 73.33 109.743 174.709 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -72.44 -44.45 62.37 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.195 -0.457 . . . . 71.32 111.144 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . 0.416 ' HB2' ' CG ' ' A' ' 500' ' ' LYS . 31.8 mt-10 -116.2 107.52 14.99 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.591 -0.522 . . . . 60.33 109.591 -178.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . 0.403 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -94.2 113.21 25.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.383 -0.371 . . . . 62.23 110.47 -179.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' MET . . . . . 0.42 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 25.0 mmt -110.7 164.8 12.39 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.166 -0.47 . . . . 62.44 110.281 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . 0.505 HD12 ' HG3' ' A' ' 542' ' ' GLU . 3.1 mm? -61.37 -55.41 31.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 72.05 111.529 -172.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -82.99 -8.04 59.6 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.104 -0.498 . . . . 74.24 111.528 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 9.2 t70 -82.28 -27.26 32.48 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.312 -0.404 . . . . 70.11 110.521 -175.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.471 ' HB2' HG22 ' A' ' 540' ' ' VAL . . . -63.27 -41.73 99.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 73.4 111.614 -177.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . 0.467 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 42.48 -158.2 0.07 OUTLIER Glycine 0 CA--C 1.526 0.742 0 O-C-N 123.783 0.677 . . . . 51.3 114.422 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -109.6 115.69 30.36 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.007 -0.738 . . . . 65.14 109.007 172.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -89.48 131.67 35.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.349 0.595 . . . . 73.35 111.145 -176.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.94 125.48 33.55 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.434 -0.803 . . . . 75.42 110.186 178.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.511 HD11 ' HB ' ' A' ' 484' ' ' VAL . 44.6 tp -92.55 112.32 24.23 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.478 -0.564 . . . . 74.24 109.478 177.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . 0.424 ' SG ' HD11 ' A' ' 487' ' ' LEU . 62.2 m -107.42 114.89 29.2 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.882 -0.599 . . . . 75.31 110.321 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.601 ' C ' ' H ' ' A' ' 531' ' ' GLY . 72.2 p -109.89 -165.39 1.0 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.054 -0.521 . . . . 74.01 109.874 178.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 530' ' ' SER . . . . . 0.437 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 20.3 m -48.6 6.65 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.742 1.217 . . . . 72.12 114.18 171.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . 0.601 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.44 26.62 1.95 Allowed Glycine 0 N--CA 1.451 -0.356 0 O-C-N 122.092 -0.38 . . . . 63.2 112.949 -176.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -110.45 144.38 17.08 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 109.406 -1.477 . . . . 72.43 109.406 163.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.58 132.39 48.21 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 117.83 0.815 . . . . 73.15 111.613 -171.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -141.12 128.59 21.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.697 -0.683 . . . . 62.35 109.451 172.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.426 HD12 ' N ' ' A' ' 536' ' ' ALA . 2.7 tm? -114.8 131.95 56.64 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 110.101 -0.333 . . . . 71.1 110.101 -174.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.78 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -128.95 158.17 39.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.53 -0.305 . . . . 71.04 110.583 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -131.9 117.49 18.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.533 -0.303 . . . . 72.13 110.19 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.464 HD13 HG22 ' A' ' 465' ' ' VAL . 37.3 tp -106.1 128.71 54.07 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.979 -0.555 . . . . 74.2 109.831 178.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.645 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.3 mp -117.89 108.7 25.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 109.365 -0.605 . . . . 71.44 109.365 177.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 465' ' ' VAL . 66.9 t -90.64 132.37 35.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.784 -0.45 . . . . 72.02 109.784 178.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -120.89 157.9 28.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.815 -0.63 . . . . 73.23 110.333 -175.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . 0.505 ' HG3' HD12 ' A' ' 519' ' ' LEU . 39.0 mt-10 -107.9 117.77 35.0 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.967 -0.561 . . . . 64.32 110.38 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.871 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 9.6 mmpt? . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.31 -0.852 . . . . 75.42 109.58 171.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.629 0 N-CA-C 111.944 -0.463 . . . . 70.05 111.944 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 26.3 t -98.68 142.45 30.23 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 110.35 -0.241 . . . . 72.44 110.35 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -102.64 -35.91 8.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.098 0.475 . . . . 71.51 110.341 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 51.3 ttp -94.86 109.66 45.28 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.358 -0.837 . . . . 63.12 110.177 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -72.3 132.75 19.84 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 121.883 1.722 . . . . 71.23 111.136 177.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.469 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 83.0 t -67.08 111.51 2.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.064 0.459 . . . . 71.1 110.065 178.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 60.1 tp -91.22 148.63 22.22 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.498 -0.773 . . . . 62.4 110.344 -176.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . 0.516 HD11 HD21 ' A' ' 527' ' ' LEU . 25.2 mt -94.79 99.52 9.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.232 -0.655 . . . . 74.32 109.232 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 12.5 p -70.02 -34.51 73.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.006 -0.543 . . . . 73.33 110.904 -176.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . . . . . . . . . 3.1 tpp180 -116.77 105.52 49.6 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 116.03 -0.532 . . . . 72.24 109.937 174.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -66.55 168.86 15.45 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.193 2.595 . . . . 74.12 111.254 175.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.638 ' HB2' ' HB1' ' A' ' 536' ' ' ALA . 2.5 mm? -65.0 153.59 40.22 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.811 -0.44 . . . . 72.3 109.811 -178.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -66.37 152.99 43.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.412 0.625 . . . . 73.1 111.652 -170.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -92.02 9.01 35.03 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.816 1.043 . . . . 73.31 113.816 -167.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.13 153.86 39.41 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.572 -0.851 . . . . 75.22 112.109 -166.37 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.469 ' CD1' ' HB ' ' A' ' 539' ' ' ILE . 2.3 pt? -118.02 144.9 45.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.291 -1.322 . . . . 72.44 110.798 -170.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.402 HG12 ' HB ' ' A' ' 471' ' ' VAL . 31.2 m -117.71 177.64 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.225 0.536 . . . . 74.11 112.131 -174.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' MET . . . . . 0.485 ' HE3' ' N ' ' A' ' 466' ' ' MET . 0.0 OUTLIER -93.81 171.12 9.07 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.543 -0.753 . . . . 75.54 110.707 179.814 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . 0.505 HG23 ' HG2' ' A' ' 542' ' ' GLU . 46.8 t -59.67 125.81 16.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.211 -0.449 . . . . 51.11 111.32 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 81.96 3.4 90.59 Favored Glycine 0 CA--C 1.517 0.201 0 CA-C-N 115.889 -0.596 . . . . 63.1 113.065 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -96.01 136.99 35.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.752 0.311 . . . . 74.14 110.608 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . 0.476 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 1.5 ptm180 -66.84 146.69 54.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.824 -0.625 . . . . 74.32 111.377 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.402 ' HB ' HG12 ' A' ' 465' ' ' VAL . 7.7 p -147.38 137.94 17.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.579 -0.737 . . . . 73.23 109.643 175.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.517 ' HG3' HG13 ' A' ' 513' ' ' ILE . 13.0 mp0 -107.68 130.96 54.88 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.871 0.367 . . . . 73.15 110.559 178.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.561 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 57.8 m-85 -108.07 113.21 26.2 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.574 -0.528 . . . . 72.33 109.574 170.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -95.81 132.45 41.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.649 -0.705 . . . . 75.13 110.388 -176.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 7.0 p -141.29 118.54 11.38 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.875 0.369 . . . . 73.2 110.613 177.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.975 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 23.4 mt-10 -112.16 138.24 49.12 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.527 -0.545 . . . . 75.42 109.527 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.469 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 26.2 m -122.6 173.12 8.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.578 -0.283 . . . . 71.21 111.304 -178.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 15.4 m -61.61 -36.27 80.26 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.152 0.797 . . . . 73.35 113.152 -175.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -119.72 156.25 30.89 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.421 -0.215 . . . . 72.1 110.421 -172.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . 0.467 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 0.1 OUTLIER -86.34 143.72 27.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.095 0.474 . . . . 73.22 110.563 -179.005 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 72.62 3.38 58.57 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.821 -0.704 . . . . 71.33 112.733 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.459 ' HB2' HG21 ' A' ' 477' ' ' VAL . . . -56.07 134.38 52.59 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.845 0.355 . . . . 74.22 110.959 -179.048 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -78.09 139.3 39.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.748 -0.66 . . . . 74.23 110.058 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.546 ' HB ' HD11 ' A' ' 527' ' ' LEU . 20.1 m -127.44 150.58 33.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.049 0.452 . . . . 72.3 110.875 -178.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . 0.529 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 65.4 tttp -108.2 122.09 46.2 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.608 -0.724 . . . . 73.32 109.378 179.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . 0.521 ' HB3' HD11 ' A' ' 493' ' ' LEU . 59.1 m95 -101.34 122.22 43.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.945 0.403 . . . . 75.32 110.623 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . 0.423 HD11 ' HE3' ' A' ' 485' ' ' LYS . 86.0 mt -130.15 139.08 50.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.865 -0.607 . . . . 63.04 111.34 -176.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.62 ' O ' HG13 ' A' ' 491' ' ' VAL . 3.7 tmmm? -115.3 106.52 14.13 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.085 -1.08 . . . . 73.31 108.085 168.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 51.79 34.37 13.06 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.162 -0.472 . . . . 70.33 111.253 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.42 -14.57 60.78 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.807 -0.711 . . . . 51.21 114.015 175.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . 0.62 HG13 ' O ' ' A' ' 488' ' ' LYS . 6.2 p -87.89 139.72 16.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-N 117.862 0.831 . . . . 51.03 110.559 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -66.59 124.18 22.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.986 -0.552 . . . . 75.2 111.567 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.521 HD11 ' HB3' ' A' ' 486' ' ' TRP . 94.1 mt -84.15 106.81 16.08 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.921 -0.77 . . . . 73.35 108.921 171.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 5.5 t -64.39 129.09 38.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.331 0.586 . . . . 74.43 111.656 -174.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.16 3.01 18.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.587 -0.733 . . . . 74.01 110.455 176.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -59.6 -54.27 48.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.099 -0.5 . . . . 72.14 109.954 173.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -149.34 111.62 4.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.609 -0.723 . . . . 74.35 109.833 174.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.2 OUTLIER -124.6 125.83 44.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.061 -0.518 . . . . 72.44 110.229 -178.119 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -94.81 -42.08 8.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.452 0.644 . . . . 74.35 110.17 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . 0.419 ' HZ2' ' CG ' ' A' ' 521' ' ' ASP . 33.8 mtmt -80.17 -44.25 20.17 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.318 -0.856 . . . . 71.13 110.895 -173.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.444 ' O ' ' HB ' ' A' ' 498' ' ' THR . 5.1 m-85 -104.95 141.82 35.88 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.027 -0.731 . . . . 74.1 109.027 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 502' ' ' ARG . 21.0 mtp180 -128.26 123.22 33.59 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.111 0.481 . . . . 65.42 109.742 176.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -94.77 127.8 41.03 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.634 -0.712 . . . . 74.32 110.368 -174.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.595 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 1.3 mptm? -114.4 144.85 42.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.421 -0.354 . . . . 73.25 110.679 177.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -116.24 130.35 56.74 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.051 -0.522 . . . . 72.34 109.823 177.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -138.83 86.83 2.17 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.136 0.493 . . . . 75.2 110.06 175.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 63.7 -104.28 0.83 Allowed Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.899 -0.591 . . . . 71.54 112.551 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . 0.467 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 21.6 mt-30 -95.43 -15.36 23.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.865 0.365 . . . . 73.51 110.797 -176.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.975 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 5.7 ptt180 -106.93 139.58 41.1 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.507 0.67 . . . . 73.53 111.786 -175.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -114.5 143.85 44.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.179 -0.919 . . . . 72.23 108.71 176.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . 0.595 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 84.6 m-70 -118.14 128.0 54.31 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.339 -0.245 . . . . 74.24 110.339 -177.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.561 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 57.7 tp -104.16 103.86 13.7 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.793 -0.447 . . . . 75.24 109.793 174.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.517 HG13 ' HG3' ' A' ' 472' ' ' GLU . 1.7 mp -98.23 118.93 45.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.025 -0.534 . . . . 74.23 110.217 177.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.476 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 62.2 mt -100.17 113.2 34.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.813 -0.63 . . . . 62.14 109.659 175.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -75.47 -46.98 29.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.102 0.477 . . . . 71.51 110.611 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -121.17 108.33 13.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.727 -0.67 . . . . 71.2 109.629 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . 0.452 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -91.37 117.34 29.58 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.156 -0.475 . . . . 74.14 110.302 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 25.7 mmt -108.14 166.85 10.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.448 -0.342 . . . . 73.41 110.548 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.73 -53.32 59.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 45.3 111.214 -174.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -77.69 -18.04 57.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.818 -0.628 . . . . 72.42 110.975 -175.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . 0.419 ' CG ' ' HZ2' ' A' ' 500' ' ' LYS . 83.9 m-20 -80.17 -21.02 43.49 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.106 -0.497 . . . . 71.11 111.831 -174.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.511 ' HA ' HD22 ' A' ' 538' ' ' LEU . . . -63.36 -42.85 98.91 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.966 -0.293 . . . . 72.33 110.892 -177.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.23 -158.66 0.06 OUTLIER Glycine 0 C--N 1.335 0.498 0 CA-C-N 115.282 -0.872 . . . . 54.24 114.02 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 -118.98 108.64 15.0 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.087 -0.709 . . . . 75.41 109.087 170.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . 0.45 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 16.1 m-30 -85.19 132.81 34.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.084 -0.507 . . . . 74.5 111.186 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -134.89 119.25 17.84 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.539 -0.755 . . . . 64.41 109.641 176.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.546 HD11 ' HB ' ' A' ' 484' ' ' VAL . 40.9 tp -89.02 117.95 28.4 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.244 -0.434 . . . . 73.41 110.171 -177.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . 0.529 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 70.0 m -104.45 122.88 46.45 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.975 -0.557 . . . . 72.4 109.976 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.581 ' C ' ' H ' ' A' ' 531' ' ' GLY . 0.2 OUTLIER -116.54 -167.08 1.23 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.889 -0.596 . . . . 74.32 110.275 -175.724 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 530' ' ' SER . . . . . 0.432 ' H ' HG22 ' A' ' 529' ' ' THR . 9.9 m -52.11 7.4 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.418 1.487 . . . . 62.12 114.082 173.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . 0.581 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.14 26.73 1.99 Allowed Glycine 0 N--CA 1.452 -0.293 0 N-CA-C 111.69 -0.564 . . . . 73.12 111.69 -168.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -123.75 142.29 14.17 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 109.168 -1.573 . . . . 71.44 109.168 165.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.29 121.36 20.03 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 117.701 0.751 . . . . 73.21 110.694 -173.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -118.28 139.08 51.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.174 -0.466 . . . . 72.25 110.745 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.402 HD12 ' N ' ' A' ' 536' ' ' ALA . 3.0 tm? -106.61 134.96 48.96 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.568 -0.53 . . . . 74.52 109.568 -177.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.638 ' HB1' ' HB2' ' A' ' 460' ' ' LEU . . . -118.47 152.58 35.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.771 0.32 . . . . 55.51 111.242 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -117.19 116.18 26.77 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.119 -0.492 . . . . 74.34 109.901 175.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.511 HD22 ' HA ' ' A' ' 522' ' ' ALA . 28.1 tp -129.82 115.9 17.92 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.989 0.424 . . . . 72.34 109.878 175.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.469 ' HB ' ' CD1' ' A' ' 464' ' ' LEU . 62.0 mt -126.95 109.05 19.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.333 -0.617 . . . . 73.43 109.333 176.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.487 HG23 ' HB1' ' A' ' 522' ' ' ALA . 79.2 t -89.67 127.83 42.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 N-CA-C 109.284 -0.636 . . . . 50.34 109.284 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -126.65 144.3 50.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.848 -0.615 . . . . 73.25 110.855 -174.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . 0.505 ' HG2' HG23 ' A' ' 467' ' ' VAL . 37.7 mt-10 -89.2 109.95 20.76 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.115 -0.698 . . . . 72.54 109.115 173.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 58.1 pttt . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.539 -0.743 . . . . 73.02 109.961 -178.433 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.754 0 N-CA-C 112.479 -0.248 . . . . 64.45 112.479 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 48.9 m 64.96 19.83 11.95 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 122.835 0.454 . . . . 71.24 111.606 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 3.2 t-160 -92.62 83.28 4.86 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.447 -0.946 . . . . 62.34 108.447 177.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 23.8 ptm -98.69 138.93 20.79 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 116.122 -0.49 . . . . 71.41 111.378 -172.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -81.22 131.93 7.96 Favored 'Trans proline' 0 N--CA 1.448 -1.165 0 C-N-CA 122.343 2.029 . . . . 72.11 110.214 169.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.451 ' H ' ' HB2' ' A' ' 530' ' ' SER . 98.2 t -74.86 110.27 9.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.817 -0.438 . . . . 71.35 109.817 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 60.4 tp -79.49 129.95 34.95 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.624 -0.716 . . . . 71.22 110.151 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . 0.468 HD11 HD21 ' A' ' 527' ' ' LEU . 42.3 mt -80.27 98.23 3.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.884 -0.784 . . . . 70.02 108.884 175.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 35.7 p -69.62 -39.45 77.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.627 -0.715 . . . . 71.04 111.382 -172.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.667 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 6.4 tpt180 -102.81 122.46 45.75 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.843 -0.617 . . . . 74.01 110.5 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.43 165.72 23.98 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.87 2.38 . . . . 73.35 112.294 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.522 ' CB ' ' HB3' ' A' ' 536' ' ' ALA . 4.1 mm? -80.26 172.01 14.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.129 -0.487 . . . . 75.31 111.408 -179.008 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . 0.54 ' HG3' ' OE1' ' A' ' 463' ' ' GLN . 0.3 OUTLIER -69.3 138.31 53.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.495 -0.775 . . . . 74.2 111.561 -175.64 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -104.97 8.56 34.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.983 -1.008 . . . . 70.34 113.321 -169.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . 0.54 ' OE1' ' HG3' ' A' ' 461' ' ' GLU . 0.2 OUTLIER -124.07 152.73 42.34 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 119.54 -0.864 . . . . 72.11 112.151 -168.709 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.578 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.3 pt? -100.4 146.43 27.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.495 -1.23 . . . . 73.52 111.433 -171.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.468 HG12 ' HB ' ' A' ' 471' ' ' VAL . 27.1 m -117.82 177.09 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.04 0.447 . . . . 71.34 110.508 175.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' MET . . . . . 0.408 ' HG2' ' HG3' ' A' ' 543' ' ' LYS . 37.7 mtm -118.18 159.77 22.73 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.001 -0.545 . . . . 74.55 110.135 -177.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . 0.481 HG22 ' HG2' ' A' ' 542' ' ' GLU . 64.8 t -55.27 124.33 8.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.004 0.43 . . . . 72.41 111.495 -174.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.41 -11.96 58.31 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.975 -0.631 . . . . 54.44 112.616 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -102.98 145.3 30.08 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.102 -0.333 . . . . 73.54 110.102 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . 0.495 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 5.4 ptp180 -86.76 135.1 33.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.268 0.556 . . . . 73.24 111.649 -177.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.468 ' HB ' HG12 ' A' ' 465' ' ' VAL . 7.1 p -119.1 133.96 64.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.622 -0.717 . . . . 73.2 110.019 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -115.44 127.9 55.66 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.507 -0.315 . . . . 64.11 110.176 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.442 ' HB3' HD12 ' A' ' 460' ' ' LEU . 96.5 m-85 -104.77 115.65 30.67 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.479 -0.563 . . . . 74.14 109.479 177.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.42 133.96 47.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.234 -0.439 . . . . 72.14 110.046 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 509' ' ' ARG . 20.9 p -149.41 147.56 28.42 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.194 -0.457 . . . . 74.43 110.681 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.667 ' HB2' ' HB3' ' A' ' 458' ' ' ARG . 49.1 mt-10 -123.07 138.75 54.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.839 0.352 . . . . 65.13 110.286 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 18.6 m -113.11 163.3 10.44 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.928 -0.578 . . . . 74.24 109.742 174.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 11.5 t -60.67 -38.35 84.63 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.162 0.43 . . . . 72.35 112.162 -175.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . 0.515 ' HB3' ' HB1' ' A' ' 482' ' ' ALA . 6.6 tp10 -106.98 139.71 40.94 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.255 -0.276 . . . . 75.24 110.255 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.51 134.98 43.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.261 0.553 . . . . 73.12 111.157 -177.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 63.46 19.74 62.66 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.749 -0.66 . . . . 74.31 112.862 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.515 ' HB1' ' HB3' ' A' ' 479' ' ' GLU . . . -62.1 151.56 35.3 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.93 0.395 . . . . 74.21 111.077 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.54 118.89 16.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.451 0.643 . . . . 75.14 110.912 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.53 ' HB ' HD12 ' A' ' 527' ' ' LEU . 34.9 m -127.34 150.66 33.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.299 -0.864 . . . . 74.11 109.508 178.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . 0.54 ' HE2' ' HG3' ' A' ' 492' ' ' GLU . 83.6 tttt -128.31 136.33 50.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.768 0.318 . . . . 72.23 110.18 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . 0.529 ' HB3' HD11 ' A' ' 493' ' ' LEU . 90.1 m95 -102.15 125.92 48.97 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.971 0.415 . . . . 72.12 110.814 -176.813 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . 0.52 ' HG ' ' HA ' ' A' ' 492' ' ' GLU . 8.0 mp -126.32 159.53 32.88 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.926 -0.579 . . . . 61.41 110.068 176.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -141.15 116.97 10.39 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.448 -0.575 . . . . 74.33 109.448 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 57.82 34.14 24.04 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.511 0.507 . . . . 65.24 110.614 -175.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 81.98 -10.71 51.67 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.683 -0.689 . . . . 74.0 112.449 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 40.6 t -86.78 129.98 37.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.869 -0.419 . . . . 74.04 109.869 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . 0.54 ' HG3' ' HE2' ' A' ' 485' ' ' LYS . 33.1 tt0 -65.27 131.07 45.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.67 . . . . 74.31 110.259 -179.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.529 HD11 ' HB3' ' A' ' 486' ' ' TRP . 85.6 mt -85.54 118.24 24.93 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.945 -0.391 . . . . 74.31 109.945 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 5.1 t -67.18 145.85 54.82 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.571 -0.741 . . . . 75.1 111.161 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.44 16.09 12.12 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.14 -0.689 . . . . 75.42 109.14 175.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -76.98 -60.97 2.14 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.231 -0.895 . . . . 71.32 109.578 176.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 497' ' ' GLU . 0.8 OUTLIER -105.31 106.56 17.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.286 0.565 . . . . 74.24 109.899 174.595 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' THR . . . . . 0.471 HG22 ' HE1' ' A' ' 503' ' ' PHE . 2.8 p -136.73 87.62 2.3 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.392 0.615 . . . . 73.03 111.505 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -105.8 -26.69 11.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.597 -0.729 . . . . 72.54 109.339 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . 0.432 ' HE3' ' CE2' ' A' ' 501' ' ' TYR . 42.2 pttt -94.51 -22.83 17.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.262 -0.881 . . . . 71.52 110.831 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.469 ' O ' ' HB ' ' A' ' 498' ' ' THR . 6.6 m-85 -118.88 133.67 55.68 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.703 -0.48 . . . . 54.41 109.703 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' ARG . . . . . 0.613 ' HB2' ' CG2' ' A' ' 513' ' ' ILE . 33.7 mmt180 -122.99 126.79 47.83 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.902 -0.407 . . . . 74.44 109.902 176.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . 0.471 ' HE1' HG22 ' A' ' 498' ' ' THR . 88.7 m-85 -94.98 113.26 24.95 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.063 -0.347 . . . . 75.22 110.063 178.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 4.7 mptp? -102.08 119.89 39.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.608 -0.269 . . . . 72.32 111.047 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -102.62 111.91 24.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.261 -0.644 . . . . 73.54 109.261 173.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 509' ' ' ARG . 33.1 t70 -136.28 74.6 1.51 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.299 0.571 . . . . 74.25 110.137 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 82.58 -131.71 10.58 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.804 -0.712 . . . . 51.3 112.055 -178.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -79.23 -23.63 43.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.066 0.46 . . . . 60.31 110.397 -178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 506' ' ' ASP . 18.4 ptt180 -89.48 143.32 26.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.501 -0.772 . . . . 73.11 110.805 -177.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 -130.26 118.96 22.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.826 -0.624 . . . . 71.13 109.492 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 13.5 m-70 -101.87 122.84 44.76 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.993 -0.283 . . . . 74.01 110.349 -176.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 67.8 tp -105.75 108.51 20.06 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.556 -0.535 . . . . 75.23 109.556 172.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.613 ' CG2' ' HB2' ' A' ' 502' ' ' ARG . 9.8 tp -99.47 124.72 52.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.323 0.582 . . . . 74.11 110.328 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 74.5 mt -104.29 111.7 34.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 108.93 -0.767 . . . . 72.41 108.93 173.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -72.92 -44.04 61.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.132 0.491 . . . . 73.23 110.829 -176.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -131.24 108.85 9.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.815 -0.629 . . . . 75.5 109.885 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . 0.404 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -90.52 131.37 36.3 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.191 -0.459 . . . . 73.22 110.768 -178.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' MET . . . . . 0.808 ' HA ' ' HE3' ' A' ' 518' ' ' MET . 10.1 mmt -95.69 167.25 11.4 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.225 -0.443 . . . . 74.01 110.502 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . 0.445 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.7 mm? -62.39 -53.73 50.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.88 0.371 . . . . 74.43 111.593 -176.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -81.57 -12.15 58.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.114 0.483 . . . . 74.35 110.669 -177.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . 0.49 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 29.1 t70 -74.93 -16.41 60.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.713 -0.676 . . . . 74.2 111.057 -175.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.526 ' HB1' ' O ' ' A' ' 538' ' ' LEU . . . -61.42 -41.77 97.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.644 -0.253 . . . . 74.42 110.409 -178.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 40.0 -157.23 0.03 OUTLIER Glycine 0 CA--C 1.522 0.53 0 N-CA-C 116.0 1.16 . . . . 72.5 116.0 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -118.49 107.24 13.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.57 -0.815 . . . . 63.51 109.056 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -85.94 133.55 33.93 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.069 0.461 . . . . 64.33 111.283 -176.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -135.56 137.75 42.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.769 -0.65 . . . . 72.03 110.558 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.53 HD12 ' HB ' ' A' ' 484' ' ' VAL . 42.1 tp -102.87 110.09 21.89 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.054 -0.521 . . . . 64.24 110.172 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . 0.413 ' SG ' HD13 ' A' ' 487' ' ' LEU . 94.6 m -90.76 117.09 29.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.147 -0.478 . . . . 74.14 110.189 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.558 ' C ' ' H ' ' A' ' 531' ' ' GLY . 0.2 OUTLIER -115.82 -169.86 1.67 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.88 -0.6 . . . . 44.33 110.275 -177.711 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 530' ' ' SER . . . . . 0.451 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 17.3 m -55.57 8.96 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.12 1.368 . . . . 75.34 113.772 173.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . 0.558 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.76 26.88 2.03 Favored Glycine 0 N--CA 1.45 -0.405 0 CA-C-O 121.515 0.508 . . . . 71.12 111.942 -170.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -115.04 144.47 18.45 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 109.608 -1.397 . . . . 71.5 109.608 165.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -132.7 120.74 22.1 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 117.586 0.693 . . . . 72.44 111.405 -174.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -127.44 147.1 50.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.658 -0.701 . . . . 74.01 109.658 173.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.498 HD11 ' N ' ' A' ' 536' ' ' ALA . 2.0 tm? -123.43 137.76 54.74 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.879 -0.415 . . . . 44.11 109.879 -176.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.522 ' HB3' ' CB ' ' A' ' 460' ' ' LEU . . . -132.51 141.05 48.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.439 -0.346 . . . . 71.41 110.324 177.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -121.47 117.21 26.28 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.233 0.539 . . . . 65.34 110.978 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.526 ' O ' ' HB1' ' A' ' 522' ' ' ALA . 46.9 tp -102.01 140.47 36.25 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.284 -0.871 . . . . 73.41 109.162 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.578 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 5.0 mp -125.28 108.62 20.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.536 -0.542 . . . . 71.42 109.536 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.404 HG23 ' HB2' ' A' ' 517' ' ' ALA . 66.7 t -107.13 129.3 61.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.921 0.391 . . . . 74.21 110.647 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.51 150.95 50.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.833 -0.622 . . . . 63.12 109.529 178.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . 0.481 ' HG2' HG22 ' A' ' 467' ' ' VAL . 34.3 mt-10 -73.93 108.75 6.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.059 0.457 . . . . 75.21 110.407 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.484 ' HA ' ' HZ1' ' A' ' 543' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 N-CA-C 108.889 -0.782 . . . . 72.45 108.889 179.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 N-CA-C 111.999 -0.44 . . . . 71.11 111.999 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 22.2 m -64.36 132.81 51.19 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 120.885 0.374 . . . . 72.35 110.331 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -88.36 74.77 8.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.33 0.586 . . . . 73.45 110.702 -178.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 55.8 ttp -96.56 104.63 18.59 Favored Pre-proline 0 C--N 1.321 -0.647 0 N-CA-C 108.691 -0.855 . . . . 74.12 108.691 173.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -69.56 131.42 21.49 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.678 1.585 . . . . 65.22 111.205 -177.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.43 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 94.7 t -76.2 107.69 7.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 109.485 -0.561 . . . . 75.2 109.485 178.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 54.6 tp -98.43 133.42 42.84 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.67 -0.695 . . . . 70.52 110.142 -176.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 54.2 mt -74.04 102.84 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 109.242 -0.651 . . . . 74.43 109.242 178.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.25 -13.19 57.42 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.415 -0.812 . . . . 51.52 110.657 -173.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.402 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 18.8 tpp180 -137.95 112.04 8.82 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 116.001 -0.545 . . . . 74.52 109.764 175.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -57.19 166.2 4.57 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.786 2.324 . . . . 70.12 111.669 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.698 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 1.7 mm? -74.3 171.75 13.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.385 -0.371 . . . . 71.34 110.474 -175.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -66.67 148.25 52.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.868 -0.606 . . . . 73.41 111.805 -171.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -105.35 9.94 33.63 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.768 1.025 . . . . 73.22 113.768 -169.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.92 153.18 38.81 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 119.063 -1.055 . . . . 75.35 112.592 -165.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 1.9 pt? -94.18 146.9 23.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.008 -1.451 . . . . 73.41 111.353 -173.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.583 HG23 HG22 ' A' ' 540' ' ' VAL . 29.7 m -128.34 177.2 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 73.1 111.682 -175.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' MET . . . . . 0.577 ' HE1' ' HE3' ' A' ' 543' ' ' LYS . 2.0 mpt? -109.31 165.82 11.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 75.05 110.276 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . 0.413 HG13 ' HA ' ' A' ' 518' ' ' MET . 13.9 m -68.08 139.56 20.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.003 0.43 . . . . 62.55 111.263 177.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 78.61 4.03 87.31 Favored Glycine 0 CA--C 1.518 0.268 0 CA-C-N 115.899 -0.591 . . . . 62.35 113.452 175.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -108.21 143.85 36.46 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.848 -0.427 . . . . 74.34 109.848 178.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . 0.586 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 0.0 OUTLIER -66.42 140.4 58.05 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.18 0.514 . . . . 63.24 110.997 -179.134 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.446 ' HB ' ' HB ' ' A' ' 514' ' ' ILE . 4.6 t -114.52 133.37 60.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.712 -0.676 . . . . 64.5 109.654 177.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -112.37 119.47 38.37 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.054 0.454 . . . . 75.04 110.467 178.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.461 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 36.6 m-85 -109.46 130.58 55.49 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.524 -0.762 . . . . 71.2 110.635 174.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -109.65 140.55 43.35 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.016 -0.538 . . . . 72.0 110.149 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.625 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 21.9 p -149.47 125.46 10.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.788 0.328 . . . . 74.25 110.872 177.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.402 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 44.8 mt-10 -108.56 140.92 41.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.15 -0.477 . . . . 75.54 109.739 178.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.43 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 27.9 m -130.24 170.6 18.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.61 0.243 . . . . 75.53 110.658 176.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 12.5 p -70.6 -35.3 72.93 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.514 0.561 . . . . 74.1 112.514 -174.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . 0.527 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 39.6 tt0 -101.96 134.14 45.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.72 0.295 . . . . 72.2 110.93 -178.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . 0.585 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 14.0 pt-20 -79.23 132.26 36.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.954 0.407 . . . . 74.44 110.059 176.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . 0.536 ' HA2' ' HD2' ' A' ' 505' ' ' LYS . . . 75.93 12.01 84.28 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.783 -0.723 . . . . 74.11 112.437 -176.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.527 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -60.37 141.58 56.09 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.781 0.324 . . . . 74.31 111.477 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . 0.405 ' O ' ' HG2' ' A' ' 483' ' ' GLN . 0.0 OUTLIER -83.69 118.03 23.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.321 0.581 . . . . 72.23 110.558 -178.415 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 26.3 m -136.12 159.69 38.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.656 -0.702 . . . . 75.52 110.222 -178.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 66.0 pttt -136.0 152.94 51.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.806 0.336 . . . . 71.34 110.497 176.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -102.78 134.0 46.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.094 -0.503 . . . . 73.32 111.359 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . 0.543 HD13 ' SG ' ' A' ' 528' ' ' CYS . 10.7 mp -118.33 136.28 53.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.699 -0.682 . . . . 73.23 109.205 172.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.455 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 3.0 tmmm? -120.66 110.33 16.28 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.878 0.37 . . . . 73.2 110.077 -177.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.5 t70 58.04 35.66 25.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.182 -0.917 . . . . 74.32 110.591 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 92.79 -9.23 75.89 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.673 -0.694 . . . . 61.35 112.88 178.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 46.9 t -101.42 122.95 54.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 110.189 -0.3 . . . . 71.44 110.189 -179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . 0.529 ' HA ' ' HG ' ' A' ' 487' ' ' LEU . 36.0 tt0 -70.99 127.82 33.87 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.097 -0.501 . . . . 74.31 110.232 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.655 HD11 ' HE1' ' A' ' 525' ' ' TYR . 91.7 mt -77.53 119.82 21.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.269 -0.423 . . . . 74.5 110.24 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 15.0 t -71.64 144.51 49.39 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.184 0.516 . . . . 74.1 110.234 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . 0.5 ' N ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -113.98 10.3 17.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.052 -0.522 . . . . 75.12 109.983 -179.387 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -79.4 -36.2 39.49 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.112 -0.699 . . . . 75.44 109.112 175.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.77 133.79 47.2 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.809 -0.812 . . . . 74.33 108.809 172.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' THR . . . . . 0.507 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.3 OUTLIER -151.17 88.72 1.47 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.348 0.594 . . . . 62.25 111.164 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -101.92 -23.66 14.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.494 -0.775 . . . . 74.31 109.289 176.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -92.61 -22.63 19.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.505 -0.77 . . . . 75.12 110.406 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.507 ' O ' ' HB ' ' A' ' 498' ' ' THR . 27.7 m-85 -128.97 161.05 30.81 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.402 -0.363 . . . . 74.21 110.355 -176.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' ARG . . . . . 0.403 ' HD2' ' HA ' ' A' ' 502' ' ' ARG . 2.1 tpt180 -152.94 123.84 7.41 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.171 -0.678 . . . . 72.42 109.171 173.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -95.03 112.84 24.5 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.191 -0.459 . . . . 64.2 110.39 -176.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.93 124.48 48.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.973 0.416 . . . . 75.3 110.635 178.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.536 ' HD2' ' HA2' ' A' ' 481' ' ' GLY . 1.6 tppp? -91.5 126.38 36.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.706 -0.679 . . . . 75.23 109.577 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -148.12 84.3 1.51 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.327 0.584 . . . . 74.44 110.573 -176.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.4 -127.22 29.01 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.669 -0.696 . . . . 73.15 112.699 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . 0.585 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 26.0 mt-30 -84.66 -3.65 58.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.562 0.22 . . . . 75.42 111.46 -178.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -118.09 153.88 33.02 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.493 0.663 . . . . 71.41 111.176 -177.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . 0.625 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 36.3 m-70 -124.88 126.21 45.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.416 -0.811 . . . . 74.02 109.17 -179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 64.8 m-70 -101.54 117.33 34.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.518 -0.549 . . . . 74.13 109.518 -177.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.461 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 55.4 tp -101.32 121.68 42.32 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.293 -0.412 . . . . 73.44 110.059 178.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 10.8 tp -106.39 130.3 58.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.729 -0.471 . . . . 73.33 109.729 176.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.586 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 54.6 mt -105.47 112.59 39.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.781 -0.822 . . . . 73.02 108.781 171.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -75.34 -48.49 22.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.956 -0.566 . . . . 64.42 110.646 -176.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -122.18 108.41 13.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.87 -0.605 . . . . 71.2 110.125 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -101.82 136.45 41.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.1 -0.5 . . . . 61.55 111.288 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' MET . . . . . 0.413 ' HA ' HG13 ' A' ' 467' ' ' VAL . 9.3 mmt -126.47 175.97 7.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.951 -0.568 . . . . 75.44 110.711 175.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -61.49 -55.66 28.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.38 -0.373 . . . . 75.32 111.586 -171.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -84.14 -10.15 58.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.821 0.343 . . . . 75.42 111.376 -177.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -80.15 -13.0 59.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.128 -0.487 . . . . 52.45 109.876 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.509 ' HA ' HD23 ' A' ' 538' ' ' LEU . . . -70.73 -41.64 71.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.195 -0.457 . . . . 72.22 111.021 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.54 -158.25 0.07 OUTLIER Glycine 0 CA--C 1.523 0.583 0 N-CA-C 114.975 0.75 . . . . 63.51 114.975 176.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -117.22 110.9 18.71 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.271 -0.64 . . . . 73.32 109.271 174.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . 0.655 ' HE1' HD11 ' A' ' 493' ' ' LEU . 30.1 m-85 -85.03 131.72 34.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.489 0.662 . . . . 64.12 111.756 -174.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.78 126.74 25.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.958 -1.019 . . . . 74.13 109.699 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 47.4 tp -87.99 115.29 25.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.135 -0.484 . . . . 75.13 109.971 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . 0.543 ' SG ' HD13 ' A' ' 487' ' ' LEU . 76.3 m -94.61 113.08 24.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.133 0.492 . . . . 72.54 109.864 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.467 ' C ' ' H ' ' A' ' 531' ' ' GLY . 54.6 p -116.85 -166.78 1.2 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.573 -0.74 . . . . 61.53 111.401 -174.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 19.2 m -59.88 6.56 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.792 1.237 . . . . 71.45 113.234 174.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . 0.467 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.47 28.22 1.65 Allowed Glycine 0 C--O 1.228 -0.251 0 C-N-CA 120.992 -0.623 . . . . 74.14 113.677 -176.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -116.55 138.14 14.16 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 109.607 -1.397 . . . . 73.21 109.607 163.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.67 143.31 51.09 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 117.8 0.8 . . . . 73.53 112.302 -172.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -154.59 143.78 21.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.103 -0.953 . . . . 73.01 109.097 175.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.44 HD13 ' N ' ' A' ' 536' ' ' ALA . 3.2 tm? -127.02 135.73 51.24 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.852 -0.425 . . . . 53.03 109.852 -176.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.698 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -135.43 159.99 39.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.267 -0.424 . . . . 74.34 110.561 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -125.56 120.42 30.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.044 -0.526 . . . . 75.41 110.218 -178.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.509 HD23 ' HA ' ' A' ' 522' ' ' ALA . 50.3 tp -99.67 126.99 45.78 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.264 -0.643 . . . . 75.21 109.264 178.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.419 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 66.4 mt -113.79 116.75 53.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 116.372 -0.376 . . . . 71.33 110.323 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.583 HG22 HG23 ' A' ' 465' ' ' VAL . 95.4 t -109.66 134.34 52.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.496 -0.557 . . . . 74.41 109.496 175.269 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.05 164.37 18.71 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.022 -0.733 . . . . 72.42 109.022 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -86.9 105.23 16.93 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.571 -0.529 . . . . 75.55 109.571 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.577 ' HE3' ' HE1' ' A' ' 466' ' ' MET . 53.6 pttt . . . . . 0 C--O 1.247 0.929 0 CA-C-N 115.679 -0.691 . . . . 74.25 109.471 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.527 -0.629 . . . . 60.24 111.527 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 21.5 t -145.21 175.06 10.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.791 0.296 . . . . 61.34 110.427 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -133.06 135.56 45.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.33 -0.619 . . . . 75.33 109.33 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 24.0 ptm -82.58 136.75 45.1 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-O 120.749 0.309 . . . . 73.51 111.499 -175.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -69.76 135.34 30.22 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.133 1.889 . . . . 75.3 110.644 171.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.564 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 58.8 t -65.95 114.24 3.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.918 0.389 . . . . 73.33 110.883 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 44.5 tp -89.2 157.77 18.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.686 -0.688 . . . . 64.01 110.545 -177.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . 0.491 HD13 HD23 ' A' ' 527' ' ' LEU . 37.5 mt -101.96 112.61 35.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.052 -0.522 . . . . 75.13 110.087 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 20.9 p -86.49 -26.91 24.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.29 -0.414 . . . . 71.3 111.556 -176.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.472 ' HB3' ' N ' ' A' ' 476' ' ' GLU . 7.1 tpt180 -107.1 114.35 61.42 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.277 -0.42 . . . . 74.42 110.091 177.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.95 158.12 55.78 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 122.589 2.193 . . . . 63.15 111.446 176.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.591 ' HB3' ' HB1' ' A' ' 536' ' ' ALA . 8.8 mp -73.61 160.45 31.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.115 -0.493 . . . . 64.34 110.574 -178.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . 0.461 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 0.2 OUTLIER -65.0 146.99 54.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.512 0.673 . . . . 72.44 112.216 -173.599 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -104.35 7.36 35.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.933 -1.031 . . . . 71.54 112.515 -171.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . 0.435 HE22 ' HB3' ' A' ' 461' ' ' GLU . 0.2 OUTLIER -124.49 154.13 40.99 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.872 -0.731 . . . . 74.25 111.805 -167.745 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.571 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.3 pt? -118.44 145.46 45.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.825 -1.079 . . . . 70.01 111.414 -168.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.428 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 29.3 m -119.77 177.15 3.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 71.43 111.485 -176.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -107.83 172.03 7.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.919 -0.582 . . . . 74.22 110.383 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 40.3 t -62.45 130.31 26.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.455 -0.339 . . . . 72.43 110.995 -178.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 90.54 7.37 67.02 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.776 -0.726 . . . . 73.33 112.626 178.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -117.85 138.73 51.91 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.884 0.373 . . . . 74.51 110.525 178.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . 0.549 ' O ' ' HD3' ' A' ' 470' ' ' ARG . 0.0 OUTLIER -82.02 153.6 26.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.697 -0.683 . . . . 74.34 111.451 -179.124 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.452 HG12 ' HB ' ' A' ' 514' ' ' ILE . 7.4 p -145.42 131.08 13.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.991 -0.549 . . . . 73.02 110.58 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.433 ' CG ' HD13 ' A' ' 513' ' ' ILE . 41.0 mt-10 -99.37 128.21 45.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.433 -0.349 . . . . 74.3 110.964 177.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.461 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 92.9 m-85 -107.6 112.16 24.75 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.625 -0.88 . . . . 74.04 108.625 167.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -96.45 140.24 31.38 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.232 0.539 . . . . 75.1 110.623 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.572 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 8.7 p -139.25 137.81 36.24 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.451 -0.795 . . . . 75.31 109.779 176.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.472 ' N ' ' HB3' ' A' ' 458' ' ' ARG . 45.3 mt-10 -119.46 138.98 52.78 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.529 -0.545 . . . . 70.5 109.529 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.564 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 9.6 m -122.58 152.14 26.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 116.106 -0.497 . . . . 74.41 110.917 -177.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 6.5 m -63.19 -19.63 64.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.818 -0.628 . . . . 74.12 112.094 -178.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . 0.497 ' HB3' ' HB3' ' A' ' 482' ' ' ALA . 35.8 tt0 -108.75 135.25 50.28 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.819 0.342 . . . . 75.32 110.437 -176.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . 0.649 ' HA ' ' HG2' ' A' ' 508' ' ' GLN . 13.7 pt-20 -75.49 135.96 40.64 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.177 -0.465 . . . . 71.34 110.577 -178.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . 0.433 ' HA2' ' HD3' ' A' ' 505' ' ' LYS . . . 67.05 8.74 51.26 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.145 -0.55 . . . . 74.45 113.075 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.497 ' HB3' ' HB3' ' A' ' 479' ' ' GLU . . . -57.67 139.59 53.36 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 120.849 0.356 . . . . 74.23 111.221 -177.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -79.43 128.29 33.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.648 -0.705 . . . . 72.2 110.143 -177.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.552 ' HB ' HD13 ' A' ' 527' ' ' LEU . 32.7 m -121.88 150.85 25.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.253 -0.431 . . . . 73.15 110.258 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -134.83 134.98 41.39 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.766 -0.457 . . . . 73.43 109.766 179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . 0.422 ' CD2' HD21 ' A' ' 512' ' ' LEU . 72.0 m95 -103.34 131.46 50.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.919 0.39 . . . . 75.52 111.165 -175.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . 0.548 ' HG ' ' HA ' ' A' ' 492' ' ' GLU . 10.7 mp -120.02 158.02 27.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.903 -0.589 . . . . 72.14 109.47 174.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.47 ' HE2' ' HB3' ' A' ' 488' ' ' LYS . 1.7 tmmm? -140.81 109.27 5.88 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.116 -0.327 . . . . 75.45 110.116 -178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 57.63 35.4 25.64 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.898 -0.592 . . . . 74.42 111.061 -177.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 86.94 -11.78 63.76 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.778 -0.646 . . . . 72.24 112.741 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 60.7 t -79.03 122.95 35.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.805 -0.443 . . . . 44.32 109.805 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . 0.548 ' HA ' ' HG ' ' A' ' 487' ' ' LEU . 33.4 tt0 -78.71 111.31 14.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.902 -0.59 . . . . 74.41 110.2 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 86.9 mt -68.37 134.94 51.03 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.016 0.436 . . . . 63.24 110.177 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 14.3 t -91.58 160.16 15.54 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.978 -0.555 . . . . 74.13 110.024 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 -125.82 11.94 7.84 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.813 -0.63 . . . . 74.31 110.559 -177.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -75.55 -35.06 60.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.613 -0.721 . . . . 74.43 109.801 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -136.23 139.6 42.86 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.621 -0.881 . . . . 74.22 108.621 170.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' THR . . . . . 0.552 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.6 OUTLIER -150.37 88.01 1.48 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.434 0.635 . . . . 74.11 111.166 179.094 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -104.94 -17.97 14.35 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.591 -0.732 . . . . 74.03 109.912 174.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -92.72 -47.05 7.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.733 -0.667 . . . . 65.41 109.841 174.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.552 ' O ' ' HB ' ' A' ' 498' ' ' THR . 45.6 m-85 -103.17 161.21 13.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.928 -0.578 . . . . 74.53 109.926 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' ARG . . . . . 0.454 ' HB2' HG22 ' A' ' 513' ' ' ILE . 49.1 mtp180 -144.34 135.49 25.35 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.175 -0.676 . . . . 71.3 109.175 174.09 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -107.4 113.14 26.31 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.475 -0.565 . . . . 75.43 109.475 -175.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -120.4 145.83 46.8 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.858 -0.61 . . . . 73.14 110.968 -172.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.433 ' HD3' ' HA2' ' A' ' 481' ' ' GLY . 3.7 ttmp? -128.82 118.42 22.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.847 -0.615 . . . . 73.14 109.846 -178.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . 0.515 ' HB3' ' HG3' ' A' ' 509' ' ' ARG . 15.3 t70 -127.62 82.73 2.1 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.421 -0.585 . . . . 73.31 109.421 177.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.37 -101.18 0.59 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.059 -0.591 . . . . 75.42 112.041 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . 0.649 ' HG2' ' HA ' ' A' ' 480' ' ' GLU . 20.9 mt-30 -109.19 -8.63 15.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.824 0.345 . . . . 73.42 110.822 -179.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.515 ' HG3' ' HB3' ' A' ' 506' ' ' ASP . 36.7 ptt180 -104.94 133.25 50.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.363 0.601 . . . . 61.15 110.761 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . 0.572 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 83.2 m-70 -113.65 144.62 42.61 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.818 -0.628 . . . . 73.42 109.792 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -119.8 118.32 30.51 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 110.134 -0.321 . . . . 71.01 110.134 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 486' ' ' TRP . 53.2 tp -96.55 103.5 15.42 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.597 -0.89 . . . . 64.2 108.597 170.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.531 HD12 ' HB2' ' A' ' 470' ' ' ARG . 5.4 tp -101.34 112.63 34.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 121.482 0.658 . . . . 61.52 110.505 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 60.9 mt -86.46 115.53 27.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 108.482 -0.933 . . . . 70.44 108.482 174.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -68.82 -51.52 39.84 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.961 0.41 . . . . 72.34 110.537 -177.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -133.76 109.41 9.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.802 -0.636 . . . . 74.53 109.841 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -88.0 138.43 31.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.974 0.416 . . . . 71.42 111.017 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' MET . . . . . 0.615 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 25.4 mmt -109.34 170.12 8.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.923 -0.58 . . . . 72.35 110.371 179.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . 0.511 HD13 ' HG3' ' A' ' 542' ' ' GLU . 3.0 mm? -64.24 -53.52 47.78 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.241 -0.436 . . . . 72.13 111.229 -173.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -81.38 -5.06 57.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.262 -0.426 . . . . 75.43 110.907 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . 0.615 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 7.9 t70 -86.8 -14.56 41.87 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.088 -0.505 . . . . 74.02 110.57 -176.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.511 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -69.16 -43.67 73.81 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.817 -0.353 . . . . 75.51 111.344 -175.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . 0.448 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 40.27 -158.53 0.02 OUTLIER Glycine 0 CA--C 1.524 0.655 0 N-CA-C 115.9 1.12 . . . . 74.41 115.9 172.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -111.14 111.55 22.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.78 -0.71 . . . . 73.13 109.086 170.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -86.19 131.53 34.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.028 0.442 . . . . 71.24 111.103 -179.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -132.27 126.09 32.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.589 -0.732 . . . . 72.21 110.073 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.552 HD13 ' HB ' ' A' ' 484' ' ' VAL . 45.5 tp -86.9 119.92 27.63 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.196 -0.456 . . . . 73.23 110.12 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . 0.496 ' SG ' HD12 ' A' ' 487' ' ' LEU . 86.4 m -100.88 112.97 25.51 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.457 -0.571 . . . . 72.44 109.457 177.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.559 ' C ' ' H ' ' A' ' 531' ' ' GLY . 0.2 OUTLIER -115.89 -168.39 1.41 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.642 -0.708 . . . . 65.12 110.389 -175.946 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 530' ' ' SER . . . . . 0.413 ' H ' HG22 ' A' ' 529' ' ' THR . 7.5 m -55.21 7.25 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.935 1.294 . . . . 70.42 113.694 173.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . 0.559 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.9 26.83 2.01 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-O 121.638 0.577 . . . . 72.43 111.831 -168.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -114.91 150.23 18.74 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 109.684 -1.366 . . . . 52.41 109.684 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . 0.401 ' NE2' ' H ' ' A' ' 534' ' ' ALA . 0.0 OUTLIER -134.77 142.75 46.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 117.55 0.675 . . . . 72.03 110.762 -176.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . 0.401 ' H ' ' NE2' ' A' ' 533' ' ' GLN . . . -153.06 123.48 7.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.656 -0.702 . . . . 72.44 109.778 177.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.427 HD12 ' N ' ' A' ' 536' ' ' ALA . 2.7 tm? -103.99 132.82 49.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.173 -0.467 . . . . 74.51 110.114 -177.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.591 ' HB1' ' HB3' ' A' ' 460' ' ' LEU . . . -121.02 149.25 42.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.37 -0.377 . . . . 72.4 110.42 177.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -116.31 120.58 39.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.173 -0.467 . . . . 62.12 110.084 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.443 HD21 ' HA ' ' A' ' 522' ' ' ALA . 48.3 tp -127.51 134.73 49.78 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.284 -0.416 . . . . 72.52 110.462 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.571 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.8 mp -130.8 125.23 58.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.128 -0.693 . . . . 64.13 109.128 174.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.511 HG21 ' HB1' ' A' ' 522' ' ' ALA . 70.1 t -104.41 143.71 15.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 110.02 -0.363 . . . . 72.14 110.02 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.29 150.26 48.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.756 0.312 . . . . 70.15 110.628 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . 0.511 ' HG3' HD13 ' A' ' 519' ' ' LEU . 45.2 mt-10 -89.5 123.33 33.51 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.698 -0.683 . . . . 72.52 110.185 175.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.5 ' HD2' ' C ' ' A' ' 543' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.89 0 CA-C-N 115.6 -0.727 . . . . 72.44 109.809 177.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.686 0 N-CA-C 111.868 -0.493 . . . . 61.21 111.868 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 43.2 p -106.12 -172.55 2.11 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.103 -0.332 . . . . 73.11 110.103 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -77.34 63.8 2.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.394 0.616 . . . . 72.23 110.543 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 23.4 ptm -115.22 132.57 22.99 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.449 -0.796 . . . . 74.45 110.107 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.75 135.62 57.3 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.235 1.957 . . . . 72.33 111.662 175.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.447 ' H ' ' HB2' ' A' ' 530' ' ' SER . 87.2 t -64.51 108.79 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.215 0.531 . . . . 73.24 110.408 178.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 50.1 tp -80.63 139.29 36.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.595 -0.73 . . . . 73.54 110.17 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 55.1 mt -91.14 114.93 29.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.867 -0.606 . . . . 72.32 109.789 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 24.7 p -86.2 -17.96 33.44 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.264 0.554 . . . . 75.33 111.498 -175.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.415 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 10.9 tpt85 -136.95 104.64 8.87 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.955 -0.566 . . . . 73.45 110.359 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . 0.444 ' HA ' ' HB2' ' A' ' 534' ' ' ALA . 26.2 Cg_exo -62.71 167.38 11.87 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.891 2.394 . . . . 74.05 111.285 174.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.676 ' HB2' ' CB ' ' A' ' 536' ' ' ALA . 0.8 OUTLIER -69.81 167.84 16.37 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.606 -0.516 . . . . 63.53 109.606 -177.79 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . 0.523 ' HA ' ' OE1' ' A' ' 461' ' ' GLU . 2.4 tp10 -73.15 161.59 30.42 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.264 0.554 . . . . 74.34 111.64 -172.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -104.25 8.76 36.16 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.989 1.107 . . . . 74.52 113.989 -166.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.11 154.23 37.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.381 0.991 . . . . 54.23 112.471 -165.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.674 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.5 pt? -106.56 146.83 30.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.051 -1.431 . . . . 74.3 111.576 -170.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.444 HG23 HD11 ' A' ' 538' ' ' LEU . 30.1 m -123.36 177.41 4.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.006 0.431 . . . . 65.32 111.457 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -97.5 166.75 11.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.008 -0.542 . . . . 74.23 110.986 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 38.3 t -62.08 127.35 21.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.716 -0.675 . . . . 53.12 111.604 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 88.16 -13.35 61.82 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.003 -0.617 . . . . 72.04 113.144 174.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -87.58 144.58 26.62 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.95 -0.389 . . . . 74.44 109.95 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . 0.608 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 2.3 ppt_? -76.65 145.56 38.74 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.276 0.56 . . . . 65.22 111.234 -177.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.435 HG12 ' HB ' ' A' ' 514' ' ' ILE . 7.2 p -131.9 142.26 43.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.674 -0.694 . . . . 72.43 109.978 178.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.498 ' HG2' HD12 ' A' ' 513' ' ' ILE . 34.1 mt-10 -112.19 125.3 53.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 75.54 110.546 -176.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.502 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 59.6 m-85 -112.88 123.2 49.77 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.287 -0.415 . . . . 75.02 111.34 178.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -95.02 138.33 32.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.736 -0.666 . . . . 75.51 110.543 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.622 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 6.0 p -148.81 133.3 17.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.25 -0.432 . . . . 72.12 110.387 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.468 ' HG2' ' CB ' ' A' ' 509' ' ' ARG . 43.9 mt-10 -131.78 139.81 49.02 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.36 -0.237 . . . . 71.01 110.36 -178.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 30.1 m -123.41 161.15 25.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.343 -0.39 . . . . 72.12 110.488 177.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 34.3 t -80.9 8.47 8.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.271 -0.422 . . . . 61.14 112.114 -175.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . 0.492 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 4.5 tp10 -128.85 141.27 51.35 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.029 -0.359 . . . . 75.12 110.029 -179.194 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . 0.479 ' HA ' ' HG2' ' A' ' 508' ' ' GLN . 1.0 OUTLIER -88.84 136.92 32.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.746 0.308 . . . . 75.24 110.426 -178.954 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 60.55 31.75 75.79 Favored Glycine 0 C--N 1.33 0.217 0 C-N-CA 120.706 -0.759 . . . . 75.24 111.783 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.492 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -74.46 146.27 42.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.951 0.405 . . . . 63.25 111.303 -175.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . 0.443 ' CD ' ' H ' ' A' ' 483' ' ' GLN . 0.0 OUTLIER -78.2 111.33 14.02 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.764 -0.653 . . . . 63.14 110.326 179.318 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.54 HG13 HG23 ' A' ' 529' ' ' THR . 17.3 m -131.86 151.21 34.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.666 -0.697 . . . . 71.4 110.245 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -135.06 155.13 51.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.902 0.382 . . . . 75.2 110.196 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . 0.528 ' HB3' HD11 ' A' ' 493' ' ' LEU . 52.2 m95 -105.57 127.24 52.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.132 -0.486 . . . . 70.51 110.908 -179.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . 0.54 HD13 ' SG ' ' A' ' 528' ' ' CYS . 65.1 mt -123.96 136.59 54.41 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.847 -0.615 . . . . 73.01 109.415 175.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.494 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 3.3 tmmm? -120.65 106.47 11.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.303 -0.408 . . . . 71.34 110.215 -177.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . 0.533 ' HB2' ' H ' ' A' ' 524' ' ' HIS . 13.7 t70 57.14 35.55 26.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.541 -0.754 . . . . 72.05 110.86 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 88.43 -3.72 85.28 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.794 -0.639 . . . . 71.34 112.513 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 89.5 t -94.69 128.2 46.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.722 0.296 . . . . 71.11 110.818 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . 0.517 ' HA ' ' CD2' ' A' ' 487' ' ' LEU . 4.7 tp10 -70.01 126.96 31.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.847 -0.615 . . . . 73.51 110.432 178.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.528 HD11 ' HB3' ' A' ' 486' ' ' TRP . 75.8 mt -87.55 98.01 11.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.119 0.485 . . . . 60.54 109.753 175.447 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' THR . . . . . 0.493 ' OG1' ' HG2' ' A' ' 496' ' ' GLU . 6.2 t -64.27 123.33 18.84 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.599 -0.728 . . . . 72.04 111.223 -176.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . 0.573 ' H ' ' NE ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -100.61 13.07 35.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.042 -0.526 . . . . 73.45 110.768 -179.264 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . 0.493 ' HG2' ' OG1' ' A' ' 494' ' ' THR . 10.1 mm-40 -69.22 -36.66 77.48 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.325 -0.62 . . . . 74.32 109.325 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -151.53 108.22 3.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.143 -0.935 . . . . 71.51 109.364 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' THR . . . . . 0.596 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 21.3 p -114.42 97.8 6.53 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.154 -0.475 . . . . 73.45 111.547 -176.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -91.03 -28.95 17.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.9 -0.591 . . . . 74.12 110.192 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -88.76 -46.97 8.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.941 -0.572 . . . . 75.45 110.312 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.596 ' O ' ' HB ' ' A' ' 498' ' ' THR . 26.2 m-85 -99.32 154.96 17.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.624 -0.716 . . . . 75.14 110.093 -176.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 501' ' ' TYR . 21.5 mtp85 -148.09 123.17 10.12 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.549 -0.537 . . . . 75.53 109.549 171.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . 0.456 ' HE2' HG21 ' A' ' 498' ' ' THR . 72.6 m-85 -96.06 118.37 32.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.02 -0.537 . . . . 72.32 111.465 -172.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.542 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 4.6 mptp? -105.85 146.0 30.49 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.239 -0.437 . . . . 72.41 110.054 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.435 ' HD3' ' CE1' ' A' ' 510' ' ' HIS . 26.5 ttpt -129.37 128.06 42.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.85 0.357 . . . . 71.55 111.149 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -119.05 79.03 1.34 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.657 -0.701 . . . . 75.13 109.512 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.49 -90.78 0.24 Allowed Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.838 -0.619 . . . . 53.13 112.807 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . 0.479 ' HG2' ' HA ' ' A' ' 480' ' ' GLU . 22.7 mt-30 -99.14 -26.06 14.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.804 0.335 . . . . 74.53 111.019 -177.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.468 ' CB ' ' HG2' ' A' ' 476' ' ' GLU . 17.1 ptt180 -103.55 153.74 20.24 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.21 0.529 . . . . 74.03 111.485 -173.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . 0.622 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 64.3 m-70 -124.64 156.54 37.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.045 -0.525 . . . . 74.11 110.76 -179.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . 0.542 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 42.0 m-70 -125.99 119.3 27.34 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.08 -0.711 . . . . 75.14 109.08 176.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.502 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 64.4 tp -98.3 105.68 17.86 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.447 -0.575 . . . . 75.24 109.447 174.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.498 HD12 ' HG2' ' A' ' 472' ' ' GLU . 8.5 tp -97.54 112.81 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 CA-C-O 121.502 0.668 . . . . 55.13 109.571 176.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.608 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 45.1 mt -96.66 112.08 28.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.611 -0.885 . . . . 61.03 108.611 175.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 41.0 m-80 -68.81 -45.01 72.32 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.445 0.466 . . . . 74.03 111.353 -173.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -134.32 109.59 8.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.198 -0.456 . . . . 73.53 110.185 178.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . 0.473 ' HB3' HG22 ' A' ' 540' ' ' VAL . . . -88.27 123.07 32.51 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.097 -0.501 . . . . 74.14 110.344 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' MET . . . . . 0.703 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 30.2 mmt -90.05 173.36 8.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.256 -0.429 . . . . 75.12 110.103 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.32 -54.03 50.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.949 0.404 . . . . 75.1 110.853 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -82.89 -4.48 58.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.752 -0.658 . . . . 73.11 111.103 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . 0.703 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 6.8 t70 -80.41 -19.78 45.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.305 -176.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.5 ' HA ' HD23 ' A' ' 538' ' ' LEU . . . -62.66 -41.93 99.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.147 -0.479 . . . . 74.14 111.268 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.19 -157.32 0.07 OUTLIER Glycine 0 C--N 1.335 0.513 0 O-C-N 123.924 0.765 . . . . 65.2 114.811 173.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . 0.533 ' H ' ' HB2' ' A' ' 489' ' ' ASP . 60.5 m80 -120.66 108.65 14.27 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.734 -0.839 . . . . 74.25 108.734 171.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . 0.494 ' CZ ' ' HG3' ' A' ' 488' ' ' LYS . 26.3 m-85 -85.46 132.04 34.28 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.472 0.654 . . . . 74.2 111.857 -173.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -141.29 131.86 25.46 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.113 -0.949 . . . . 73.3 109.818 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.469 HD22 ' HB2' ' A' ' 475' ' ' CYS . 61.2 tp -86.67 116.3 24.69 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.245 -0.65 . . . . 71.44 109.245 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . 0.54 ' SG ' HD13 ' A' ' 487' ' ' LEU . 64.6 m -99.73 116.31 31.52 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.424 0.63 . . . . 73.14 110.597 -176.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.567 ' C ' ' H ' ' A' ' 531' ' ' GLY . 68.0 p -115.64 -165.67 1.06 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.95 -1.023 . . . . 71.43 110.229 -177.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 530' ' ' SER . . . . . 0.447 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 2.7 m -52.68 4.25 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.645 1.178 . . . . 70.04 113.274 172.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . 0.567 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.85 27.59 1.87 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.392 -0.432 . . . . 75.5 113.233 -175.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -107.95 136.22 13.32 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 109.797 -1.321 . . . . 54.22 109.797 164.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -113.03 121.06 43.48 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 117.201 0.5 . . . . 72.43 112.224 -171.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . 0.444 ' HB2' ' HA ' ' A' ' 459' ' ' PRO . . . -121.26 140.21 52.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.933 -0.576 . . . . 74.01 109.474 171.123 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.485 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.8 tm? -128.36 138.94 52.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.767 0.318 . . . . 75.4 110.48 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.676 ' CB ' ' HB2' ' A' ' 460' ' ' LEU . . . -146.94 159.92 42.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 74.53 110.112 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -127.04 116.75 21.21 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.057 0.456 . . . . 74.3 111.057 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.5 HD23 ' HA ' ' A' ' 522' ' ' ALA . 52.6 tp -101.22 133.08 46.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.038 -0.727 . . . . 74.42 109.038 175.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.674 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 35.5 mt -125.49 116.7 47.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 109.762 -0.459 . . . . 74.22 109.762 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.473 HG22 ' HB3' ' A' ' 517' ' ' ALA . 97.8 t -112.81 120.16 62.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 120.771 0.319 . . . . 73.44 110.513 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.58 162.21 30.86 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.943 -0.571 . . . . 74.1 109.798 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -85.33 109.12 18.16 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.44 -0.578 . . . . 64.24 109.44 173.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.831 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 10.7 mmpt? . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.426 -0.797 . . . . 73.44 109.701 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.726 0 N-CA-C 111.901 -0.48 . . . . 73.24 111.901 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 20.7 t -87.14 124.49 33.32 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 72.21 110.225 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 41.3 m-70 -77.17 125.15 28.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.822 -0.626 . . . . 75.44 110.319 177.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' MET . . . . . 0.462 ' O ' ' HG3' ' A' ' 452' ' ' MET . 18.9 ptm -109.27 113.85 58.28 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 115.943 -0.571 . . . . 71.13 109.666 176.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 452' ' ' MET . 29.5 Cg_endo -63.96 151.31 85.79 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.307 2.005 . . . . 74.45 111.287 177.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.438 ' H ' ' HB2' ' A' ' 530' ' ' SER . 99.2 t -64.93 107.67 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-O 121.199 0.523 . . . . 71.31 110.063 176.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 47.3 tp -93.63 152.54 18.93 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.512 -0.767 . . . . 72.41 109.562 -177.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 56.6 mt -105.71 112.9 41.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.205 -0.452 . . . . 74.42 110.234 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 43.8 p -86.43 -33.91 20.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.181 0.515 . . . . 73.14 110.416 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.41 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 14.3 tpt180 -114.77 103.91 54.54 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.541 -0.754 . . . . 75.54 109.26 174.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.2 167.57 19.86 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.968 2.445 . . . . 65.44 112.272 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.842 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 79.6 mt -66.11 155.24 37.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.032 -0.531 . . . . 74.1 110.078 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -88.35 162.68 16.42 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.302 0.853 . . . . 73.31 113.302 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -104.53 6.33 34.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.245 -1.343 . . . . 74.31 113.93 -161.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -123.86 149.31 45.94 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 118.923 -1.111 . . . . 62.42 112.753 -162.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.601 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 0.6 OUTLIER -114.48 144.9 42.6 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.97 -1.468 . . . . 71.41 111.391 -170.523 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 28.2 m -117.92 177.93 2.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.115 -0.493 . . . . 63.22 111.303 -177.586 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -103.14 168.07 9.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.012 -0.54 . . . . 71.33 110.382 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 45.0 t -62.21 130.33 26.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.472 -0.331 . . . . 72.24 110.829 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 92.46 -11.22 72.61 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.877 -0.678 . . . . 70.22 112.616 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -101.09 144.17 30.32 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.431 -0.581 . . . . 73.42 109.431 178.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . 0.494 ' HD2' ' C ' ' A' ' 470' ' ' ARG . 0.0 OUTLIER -86.01 150.61 24.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.965 0.412 . . . . 73.21 110.72 -176.13 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 8.0 p -128.94 137.59 56.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.445 -0.576 . . . . 55.33 109.445 176.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.846 ' HG2' HG13 ' A' ' 513' ' ' ILE . 42.6 mt-10 -116.61 124.28 49.41 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.489 -0.323 . . . . 74.33 110.159 -176.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.435 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 76.9 m-85 -107.97 113.27 26.33 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.116 -0.493 . . . . 71.12 110.286 176.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -95.61 132.36 40.84 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.657 -0.701 . . . . 74.35 110.295 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.4 t -148.26 121.02 8.66 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.095 0.474 . . . . 53.43 110.507 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.87 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 46.5 mt-10 -112.63 138.72 49.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.799 -0.637 . . . . 73.32 110.058 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.441 ' O ' ' HB3' ' A' ' 508' ' ' GLN . 21.6 m -121.93 178.44 2.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.383 -0.371 . . . . 65.41 110.781 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 25.0 p -78.22 -21.61 49.73 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.598 0.592 . . . . 71.41 112.598 -174.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . 0.523 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 35.9 tt0 -119.02 138.91 52.5 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.997 0.427 . . . . 73.21 110.991 -175.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -74.41 126.96 31.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.955 -0.566 . . . . 71.11 110.368 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 64.35 26.84 70.93 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.616 -0.802 . . . . 52.33 111.953 -174.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.523 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -57.94 156.76 8.65 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.012 0.745 . . . . 62.33 113.012 -176.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -71.86 105.48 3.82 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.886 -1.052 . . . . 75.04 109.553 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.51 ' HB ' HD13 ' A' ' 527' ' ' LEU . 29.3 m -128.06 150.7 34.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.908 0.385 . . . . 73.1 110.412 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 49.4 tttp -130.29 126.8 38.13 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.206 -0.664 . . . . 74.35 109.206 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . 0.413 ' HB3' HD11 ' A' ' 493' ' ' LEU . 86.1 m95 -100.92 116.81 33.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.739 0.304 . . . . 73.44 110.885 -175.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . 0.416 HD12 ' SG ' ' A' ' 528' ' ' CYS . 7.7 mp -118.23 140.8 49.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.035 -0.529 . . . . 74.02 110.393 177.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.527 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 4.2 tmmm? -127.22 107.45 10.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.142 -0.688 . . . . 75.25 109.142 176.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 4.7 t70 58.56 35.55 24.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.577 0.703 . . . . 73.12 110.353 -178.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 92.99 -15.58 62.5 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.824 -0.703 . . . . 71.55 113.281 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 55.9 t -97.85 123.99 50.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.81 0.305 . . . . 72.43 110.561 -178.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -70.44 142.6 51.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.932 0.396 . . . . 74.04 110.75 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.728 HD12 ' HE2' ' A' ' 525' ' ' TYR . 59.7 mt -84.71 118.39 24.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.901 -0.59 . . . . 75.41 110.197 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 10.6 t -70.46 143.14 51.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.06 0.457 . . . . 72.21 110.414 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.93 7.64 11.52 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.177 -0.465 . . . . 74.44 110.596 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -62.18 -50.38 72.06 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.517 0.675 . . . . 75.02 109.579 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -152.65 118.16 5.3 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.81 -1.086 . . . . 75.52 108.82 174.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.61 121.65 16.76 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.85 0.357 . . . . 73.44 110.597 -176.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -107.49 -22.9 12.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.272 -0.422 . . . . 73.12 111.51 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . 0.41 ' HE3' ' CE2' ' A' ' 501' ' ' TYR . 52.3 mtmt -73.97 -46.74 42.01 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.422 -0.585 . . . . 74.22 109.422 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.703 ' HB3' HG12 ' A' ' 514' ' ' ILE . 0.6 OUTLIER -136.09 144.98 45.45 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.282 -0.872 . . . . 73.51 110.298 179.032 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.88 140.32 51.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.068 0.461 . . . . 74.31 110.922 178.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -95.64 120.55 36.09 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.242 -0.89 . . . . 64.21 109.789 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.547 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 0.7 OUTLIER -113.54 121.31 43.83 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.072 0.463 . . . . 74.44 110.964 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -107.51 113.51 26.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.588 -0.733 . . . . 73.31 110.476 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.53 101.4 3.98 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.426 0.631 . . . . 74.0 110.581 174.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 80.06 -131.14 10.3 Favored Glycine 0 N--CA 1.444 -0.83 0 CA-C-N 115.456 -0.793 . . . . 71.33 111.895 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . 0.441 ' HB3' ' O ' ' A' ' 477' ' ' VAL . 26.0 mt-30 -93.47 -10.63 34.34 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.817 0.341 . . . . 62.24 110.567 -178.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.87 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 25.5 ptt180 -93.52 143.83 25.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.546 0.688 . . . . 71.31 111.508 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 -124.5 117.71 24.98 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.441 -0.948 . . . . 73.33 108.441 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . 0.547 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 13.3 m-70 -101.84 127.57 48.59 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.677 -0.238 . . . . 75.03 110.739 -172.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.435 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 63.0 tp -112.7 103.55 11.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.596 -0.52 . . . . 73.53 109.596 173.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.846 HG13 ' HG2' ' A' ' 472' ' ' GLU . 1.7 mp -105.08 116.28 48.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.1 -0.5 . . . . 60.43 110.329 179.248 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.703 HG12 ' HB3' ' A' ' 501' ' ' TYR . 53.7 mt -97.81 112.78 30.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.075 -0.713 . . . . 73.5 109.075 175.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -71.19 -44.25 65.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.091 -0.504 . . . . 72.32 110.542 -175.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -129.86 109.14 10.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.911 -0.586 . . . . 72.32 109.758 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -89.98 132.16 35.5 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.062 -0.517 . . . . 70.21 110.335 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 26.1 mmt -112.06 166.51 11.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.076 -0.511 . . . . 73.11 110.554 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -58.18 -53.92 52.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 75.42 111.077 -174.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -82.6 -10.78 58.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.075 -0.511 . . . . 74.42 111.651 -176.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -85.9 -14.03 46.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.44 -0.346 . . . . 73.44 110.466 -177.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.464 ' HB3' HG23 ' A' ' 540' ' ' VAL . . . -62.72 -41.98 99.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.313 -0.403 . . . . 71.4 111.361 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.68 -158.13 0.08 OUTLIER Glycine 0 C--N 1.337 0.589 0 O-C-N 123.835 0.709 . . . . 61.22 114.472 176.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -126.97 112.38 15.2 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.605 -0.887 . . . . 74.02 108.605 172.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . 0.728 ' HE2' HD12 ' A' ' 493' ' ' LEU . 51.7 m-85 -85.74 131.97 34.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.238 0.542 . . . . 75.21 111.494 -172.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -137.55 120.07 16.02 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.553 -0.749 . . . . 73.53 110.035 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.51 HD13 ' HB ' ' A' ' 484' ' ' VAL . 45.2 tp -87.6 123.35 32.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.152 -0.476 . . . . 75.3 109.775 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . 0.416 ' SG ' HD12 ' A' ' 487' ' ' LEU . 64.6 m -108.68 112.73 25.19 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.054 0.454 . . . . 72.53 110.202 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.596 ' C ' ' H ' ' A' ' 531' ' ' GLY . 55.1 p -114.61 -165.2 0.99 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.085 -0.507 . . . . 74.32 109.716 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 530' ' ' SER . . . . . 0.438 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 2.1 m -49.79 4.53 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.087 1.143 . . . . 71.24 114.087 173.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . 0.596 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.55 26.84 2.08 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 121.446 0.47 . . . . 74.12 112.789 -173.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -109.04 138.02 14.52 Favored Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 109.21 -1.556 . . . . 73.21 109.21 164.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.74 126.14 46.91 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 117.31 0.555 . . . . 71.41 111.201 -171.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -131.89 133.88 45.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.79 -0.641 . . . . 73.54 109.636 174.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.477 HD13 ' N ' ' A' ' 536' ' ' ALA . 1.4 tm? -116.81 133.69 55.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.933 -0.395 . . . . 72.13 109.933 -177.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.842 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -122.09 131.22 53.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.431 -0.35 . . . . 74.44 110.801 178.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -102.41 116.41 32.56 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.112 -0.494 . . . . 72.33 110.149 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.457 HD21 ' HA ' ' A' ' 522' ' ' ALA . 33.6 tp -124.11 118.75 27.63 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.266 -0.425 . . . . 74.24 110.088 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.601 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.2 mp -124.21 109.68 23.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 109.065 -0.717 . . . . 75.54 109.065 176.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.464 HG23 ' HB3' ' A' ' 522' ' ' ALA . 73.0 t -89.88 129.16 41.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.118 0.485 . . . . 75.51 110.249 -177.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -116.04 168.4 10.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.46 -0.791 . . . . 71.02 110.222 -174.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -115.03 108.68 17.0 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.524 -0.307 . . . . 73.2 110.563 174.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 50.1 pttt . . . . . 0 C--O 1.247 0.93 0 CA-C-N 115.569 -0.742 . . . . 75.04 110.093 177.125 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 N--CA 1.457 -0.643 0 CA-C-O 120.916 0.298 . . . . 73.439999999999998 112.267 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.53 ' HB ' ' HB2' ' A' ' 530' ' ' SER . 65.6 t -65.94 108.78 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.295 -0.631 . . . . 73.430000000000007 109.295 172.46 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 54.7 tp -95.15 137.29 34.4 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.426 -0.807 . . . . 70.019999999999996 110.269 -175.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 58.1 mt -80.29 101.48 5.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.072 -0.714 . . . . 71.109999999999999 109.072 175.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 6.5 p -74.42 -18.97 60.57 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.909 -0.587 . . . . 62.420000000000002 111.964 -173.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.4 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 36.7 tpt85 -122.97 108.08 32.8 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.438 -0.346 . . . . 72.519999999999996 110.122 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.92 158.95 27.1 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 123.146 2.564 . . . . 61.240000000000002 112.48 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.61 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 94.9 mt -80.93 160.81 24.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.888 -0.596 . . . . 43.009999999999998 111.459 -174.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 461' ' ' GLU . . . . . 0.68 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 0.1 OUTLIER -65.91 139.59 58.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.652 -0.703 . . . . 71.430000000000007 112.069 -175.989 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -106.12 10.74 31.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.92 -1.037 . . . . 62.219999999999999 112.331 -173.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 463' ' ' GLN . . . . . 0.421 ' OE1' ' HG3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -120.63 153.03 37.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 119.685 -0.806 . . . . 51.229999999999997 112.362 -163.733 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.568 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.2 pt? -91.7 146.7 23.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.164 -1.38 . . . . 75.400000000000006 112.072 -169.097 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.499 HG21 HG22 ' A' ' 471' ' ' VAL . 28.2 m -125.32 178.43 3.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.822 -0.627 . . . . 64.129999999999995 111.121 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -118.36 161.65 19.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.095 -0.502 . . . . 73.319999999999993 110.775 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 52.7 t -66.17 126.59 25.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 74.030000000000001 110.738 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 95.13 -3.97 67.2 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.75 -0.738 . . . . 75.010000000000005 112.304 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -104.91 150.61 24.73 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.89 -0.411 . . . . 74.209999999999994 109.89 178.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 470' ' ' ARG . . . . . 0.463 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 17.3 ptp180 -81.58 153.19 26.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.984 0.421 . . . . 74.129999999999995 110.957 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.499 HG22 HG21 ' A' ' 465' ' ' VAL . 2.3 t -120.57 119.33 59.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.044 -0.525 . . . . 72.519999999999996 109.93 177.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -106.02 119.18 38.54 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.064 -0.347 . . . . 62.030000000000001 110.064 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.68 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 98.3 m-85 -108.85 139.31 43.86 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.884 -0.598 . . . . 64.349999999999994 110.28 174.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.95 123.85 50.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.544 -0.298 . . . . 73.219999999999999 110.31 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 26.8 p -149.39 135.44 18.94 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.912 0.387 . . . . 64.319999999999993 110.479 177.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.442 ' HA ' ' HA ' ' A' ' 509' ' ' ARG . 43.8 mt-10 -128.18 155.52 44.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.895 -0.593 . . . . 73.310000000000002 109.437 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.5 HG21 ' HB3' ' A' ' 482' ' ' ALA . 14.2 m -125.3 166.68 20.66 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 116.424 -0.353 . . . . 72.519999999999996 110.461 177.109 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 25.8 p -78.93 8.4 5.64 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.438 0.533 . . . . 61.210000000000001 112.438 -174.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 479' ' ' GLU . . . . . 0.566 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 37.1 tt0 -144.54 133.93 23.19 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.048 -0.353 . . . . 75.319999999999993 110.048 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -79.0 134.11 36.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.317 0.579 . . . . 72.019999999999996 110.731 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 481' ' ' GLY . . . . . 0.516 ' HA2' ' HD3' ' A' ' 505' ' ' LYS . . . 71.4 16.28 75.48 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.47 -0.786 . . . . 72.239999999999995 112.118 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.566 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -61.56 156.54 19.41 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.146 0.498 . . . . 61.0 111.821 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -81.25 133.6 35.47 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.344 -0.844 . . . . 63.030000000000001 109.878 -178.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.565 ' HB ' HD11 ' A' ' 527' ' ' LEU . 26.8 m -137.36 175.53 9.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.892 0.377 . . . . 73.430000000000007 110.858 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 485' ' ' LYS . . . . . 0.569 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 55.9 tttp -151.31 122.63 7.8 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.306 -0.627 . . . . 71.549999999999997 109.306 -177.842 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -101.92 120.1 39.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.858 0.361 . . . . 72.200000000000003 111.143 -176.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 487' ' ' LEU . . . . . 0.524 HD21 ' HE3' ' A' ' 485' ' ' LYS . 98.0 mt -120.45 135.51 55.03 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.911 -0.586 . . . . 73.150000000000006 110.411 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.413 ' HE2' ' HB3' ' A' ' 488' ' ' LYS . 5.2 tmmm? -111.88 104.77 13.09 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.572 -0.899 . . . . 73.140000000000001 108.572 174.112 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.31 36.66 16.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.598 -0.728 . . . . 65.319999999999993 110.877 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.08 -14.11 61.53 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.833 -0.698 . . . . 32.039999999999999 113.266 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 39.9 t -100.76 123.2 53.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 122.47 -0.429 . . . . 54.229999999999997 110.43 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 492' ' ' GLU . . . . . 0.422 ' HA ' HD23 ' A' ' 487' ' ' LEU . 39.3 tt0 -71.77 135.69 46.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.98 0.419 . . . . 73.040000000000006 110.78 -179.019 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 91.1 mt -78.42 128.26 33.36 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.953 -0.567 . . . . 74.010000000000005 110.125 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 11.8 t -80.88 138.9 36.17 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.13 0.49 . . . . 75.019999999999996 110.036 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 495' ' ' ARG . . . . . 0.605 ' HA ' HG23 ' A' ' 498' ' ' THR . 0.0 OUTLIER -126.02 14.24 7.9 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.834 -0.621 . . . . 73.450000000000003 110.043 -178.01 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -70.49 -34.22 72.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.478 0.656 . . . . 60.350000000000001 109.304 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -144.69 107.21 4.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.014 -0.994 . . . . 75.120000000000005 109.014 173.172 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.605 HG23 ' HA ' ' A' ' 495' ' ' ARG . 22.6 p -120.21 114.87 22.56 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.221 -0.445 . . . . 73.120000000000005 111.205 -176.1 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -111.82 -18.97 12.58 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.045 0.45 . . . . 71.049999999999997 111.039 170.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -99.38 -42.84 6.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.06 -0.518 . . . . 71.099999999999994 111.136 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.49 ' HB3' HD11 ' A' ' 512' ' ' LEU . 46.4 m-85 -107.64 138.54 43.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.368 -0.378 . . . . 74.310000000000002 110.611 -176.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 502' ' ' ARG . . . . . 0.524 ' HB2' ' CG2' ' A' ' 513' ' ' ILE . 0.8 OUTLIER -118.34 123.95 46.58 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.704 0.288 . . . . 73.299999999999997 110.418 175.91 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 503' ' ' PHE . . . . . 0.438 ' CE2' HD13 ' A' ' 512' ' ' LEU . 89.5 m-85 -103.1 112.84 25.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.743 -0.662 . . . . 72.230000000000004 109.615 178.532 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.559 ' HE2' HG22 ' A' ' 513' ' ' ILE . 0.0 OUTLIER -113.79 135.82 53.54 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.978 0.418 . . . . 71.129999999999995 111.005 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.516 ' HD3' ' HA2' ' A' ' 481' ' ' GLY . 20.4 ttmt -115.15 111.89 21.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.537 -0.756 . . . . 64.530000000000001 109.699 177.037 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 506' ' ' ASP . . . . . 0.422 ' HB2' ' HG2' ' A' ' 509' ' ' ARG . 32.3 m-20 -119.58 88.17 2.88 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.542 -0.54 . . . . 73.120000000000005 109.542 177.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.65 -106.45 1.76 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.611 -0.805 . . . . 55.420000000000002 112.107 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -101.54 -15.9 16.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.582 0.229 . . . . 54.25 110.701 -177.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.442 ' HA ' ' HA ' ' A' ' 476' ' ' GLU . 26.6 ptt180 -89.76 151.54 21.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.196 0.522 . . . . 74.239999999999995 110.219 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 -132.06 136.35 47.14 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.012 -0.736 . . . . 61.439999999999998 109.012 175.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -123.9 124.09 41.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.008 0.432 . . . . 63.520000000000003 111.473 177.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.49 HD11 ' HB3' ' A' ' 501' ' ' TYR . 53.1 tp -105.46 102.72 12.17 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.19 -1.041 . . . . 74.340000000000003 108.19 169.013 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.559 HG22 ' HE2' ' A' ' 504' ' ' LYS . 8.0 tp -98.68 113.2 32.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.668 0.746 . . . . 73.5 109.8 -179.099 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.463 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 60.5 mt -88.6 115.96 29.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.309 -0.86 . . . . 73.450000000000003 109.365 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -63.81 -45.37 89.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.882 0.372 . . . . 73.209999999999994 111.056 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -141.83 110.91 6.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.95 -0.568 . . . . 63.240000000000002 110.074 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -83.29 137.14 34.11 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.09 -0.505 . . . . 73.329999999999998 110.953 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 518' ' ' MET . . . . . 0.596 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 26.3 mmt -107.72 170.78 7.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.919 -0.582 . . . . 70.239999999999995 110.086 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.565 HD22 ' H ' ' A' ' 519' ' ' LEU . 2.4 mm? -64.07 -54.68 30.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.178 0.513 . . . . 73.099999999999994 110.808 -173.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -82.77 -4.84 58.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.645 -0.707 . . . . 74.340000000000003 111.089 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 521' ' ' ASP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 1.0 OUTLIER -89.3 -7.49 55.28 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.081 -0.508 . . . . 74.439999999999998 111.509 -178.496 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.637 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -74.4 -43.72 55.16 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.76 -0.376 . . . . 53.25 111.371 -177.736 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 41.41 -158.11 0.04 OUTLIER Glycine 0 CA--C 1.526 0.767 0 CA-C-O 121.95 0.75 . . . . 72.120000000000005 114.845 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -111.51 113.79 26.45 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.07 -0.715 . . . . 73.239999999999995 109.07 169.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 525' ' ' TYR . . . . . 0.594 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 60.6 m-85 -84.35 130.95 34.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.083 0.468 . . . . 64.25 110.207 -178.543 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -137.87 119.65 15.21 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.657 -0.701 . . . . 71.299999999999997 110.276 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.565 HD11 ' HB ' ' A' ' 484' ' ' VAL . 33.7 tp -89.78 109.59 20.57 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.255 -0.646 . . . . 73.209999999999994 109.255 178.144 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 528' ' ' CYS . . . . . 0.569 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 60.3 m -94.83 113.97 25.78 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.302 0.572 . . . . 75.129999999999995 110.24 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.511 HG22 HG12 ' A' ' 484' ' ' VAL . 55.8 p -116.13 -165.92 1.09 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.408 -0.815 . . . . 75.530000000000001 110.973 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 530' ' ' SER . . . . . 0.53 ' HB2' ' HB ' ' A' ' 454' ' ' VAL . 33.1 m -52.87 5.05 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.451 1.1 . . . . 54.509999999999998 113.729 172.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 531' ' ' GLY . . . . . 0.511 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.79 27.44 1.91 Allowed Glycine 0 C--N 1.33 0.224 0 O-C-N 122.018 -0.426 . . . . 75.150000000000006 113.357 -177.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -111.75 134.58 12.18 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 109.658 -1.377 . . . . 72.430000000000007 109.658 164.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -119.09 120.54 37.45 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 117.193 0.496 . . . . 62.0 111.685 -172.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -121.3 143.3 49.25 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.799 -0.815 . . . . 43.119999999999997 108.799 171.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.437 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.4 tm? -128.54 133.56 48.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.001 0.429 . . . . 53.0 110.384 -174.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.61 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -127.65 131.11 49.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.915 -0.584 . . . . 54.210000000000001 110.272 176.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -113.49 115.7 28.43 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.19 -0.671 . . . . 44.32 109.19 176.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.475 HD11 HG22 ' A' ' 465' ' ' VAL . 37.6 tp -109.46 134.61 51.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.991 -0.55 . . . . 71.450000000000003 110.349 -173.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.512 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 43.1 mt -119.86 113.69 41.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.375 -0.602 . . . . 75.209999999999994 109.375 175.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.637 HG23 ' HB2' ' A' ' 522' ' ' ALA . 85.7 t -103.89 134.66 44.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.831 -0.433 . . . . 72.439999999999998 109.831 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.36 146.07 49.58 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.295 -0.411 . . . . 74.019999999999996 110.057 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -83.4 109.31 17.21 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.939 -0.763 . . . . 70.040000000000006 108.939 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 543' ' ' LYS . . . . . 0.785 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 10.9 mmpt? . . . . . 0 C--O 1.245 0.846 0 CA-C-O 118.306 -0.854 . . . . 72.329999999999998 109.753 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo . . . . . 0 N--CA 1.456 -0.696 0 N-CA-C 110.04 -0.792 . . . . 72.420000000000002 110.04 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.418 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 92.2 t -64.36 107.6 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.37 0.605 . . . . 72.439999999999998 110.213 -176.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 44.1 tp -106.14 162.38 13.68 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.165 -0.925 . . . . 74.209999999999994 109.465 -177.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 34.1 mt -104.58 107.54 22.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 110.041 -0.355 . . . . 72.430000000000007 110.041 -177.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 457' ' ' THR . . . . . 0.5 ' O ' ' HD3' ' A' ' 459' ' ' PRO . 21.4 p -80.57 -44.01 19.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.316 0.579 . . . . 72.329999999999998 110.367 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.46 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 8.1 tpt85 -99.79 101.63 14.48 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 115.383 -0.826 . . . . 72.239999999999995 109.18 175.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 459' ' ' PRO . . . . . 0.5 ' HD3' ' O ' ' A' ' 457' ' ' THR . 17.0 Cg_exo -67.36 165.18 27.83 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.726 2.284 . . . . 65.430000000000007 111.493 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.694 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 3.2 mm? -65.86 166.45 11.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.357 -0.383 . . . . 75.439999999999998 110.395 -179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 461' ' ' GLU . . . . . 0.406 ' OE1' ' HA ' ' A' ' 461' ' ' GLU . 1.4 tp10 -69.87 157.17 37.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.481 0.657 . . . . 75.420000000000002 112.255 -172.083 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -105.49 7.67 33.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.883 -1.053 . . . . 63.149999999999999 113.649 -168.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -123.41 153.63 40.14 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.162 -1.015 . . . . 72.450000000000003 112.423 -167.678 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.658 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 1.8 pt? -108.75 145.47 35.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.177 -1.374 . . . . 72.329999999999998 110.89 -171.437 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.56 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 27.5 m -124.19 176.83 5.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.078 0.466 . . . . 73.439999999999998 111.21 -178.368 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -100.14 166.7 10.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.786 -0.643 . . . . 65.319999999999993 110.358 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 467' ' ' VAL . . . . . 0.419 HG21 ' HG2' ' A' ' 542' ' ' GLU . 24.5 t -60.03 138.25 21.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.329 -0.396 . . . . 73.430000000000007 111.254 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 82.18 -4.05 78.25 Favored Glycine 0 C--N 1.329 0.185 0 C-N-CA 121.192 -0.528 . . . . 55.25 112.809 176.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -102.46 143.32 32.34 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.181 -0.303 . . . . 75.439999999999998 110.181 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 470' ' ' ARG . . . . . 0.52 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 1.1 ptp180 -72.02 147.98 46.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.269 -0.423 . . . . 72.129999999999995 110.885 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.487 ' HB ' HG21 ' A' ' 465' ' ' VAL . 7.5 p -140.91 133.71 31.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.999 -0.546 . . . . 53.109999999999999 109.684 174.462 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.625 ' HG2' HD13 ' A' ' 513' ' ' ILE . 44.3 mt-10 -100.95 132.48 46.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.017 0.437 . . . . 71.549999999999997 110.968 -178.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.549 ' HB3' HD12 ' A' ' 460' ' ' LEU . 80.6 m-85 -124.09 112.28 16.94 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.042 -0.725 . . . . 74.010000000000005 109.042 169.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -118.52 138.65 52.38 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.102 0.477 . . . . 60.43 110.619 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.476 ' HB3' HD13 ' A' ' 460' ' ' LEU . 7.4 p -138.91 146.38 41.0 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.628 -0.714 . . . . 42.420000000000002 110.518 -178.03 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.608 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 44.3 mt-10 -116.38 138.08 51.64 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.213 -0.448 . . . . 73.140000000000001 109.821 176.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.473 HG21 ' HB3' ' A' ' 482' ' ' ALA . 14.2 m -119.27 164.83 15.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.86 -0.609 . . . . 74.129999999999995 110.874 -179.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 7.9 m -66.19 -12.87 58.75 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.723 0.638 . . . . 62.140000000000001 112.723 -174.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 479' ' ' GLU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 40.8 tt0 -129.33 145.23 51.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.733 0.301 . . . . 75.129999999999995 110.847 -176.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 480' ' ' GLU . . . . . 0.525 ' H ' ' CD ' ' A' ' 480' ' ' GLU . 0.6 OUTLIER -79.69 126.95 31.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.188 -0.46 . . . . 72.120000000000005 110.541 -179.317 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 64.0 25.86 69.75 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.962 -0.637 . . . . 62.219999999999999 112.049 -176.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.602 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -58.44 152.9 16.92 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.148 0.499 . . . . 63.039999999999999 112.129 -177.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -76.32 111.95 12.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.26 -0.882 . . . . 65.310000000000002 109.875 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.6 ' HB ' HD11 ' A' ' 527' ' ' LEU . 35.2 m -124.98 150.72 30.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.172 -0.467 . . . . 64.150000000000006 111.077 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 485' ' ' LYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 528' ' ' CYS . 45.4 tttp -121.86 129.72 52.81 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.177 -0.675 . . . . 62.119999999999997 109.177 179.308 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -101.17 126.84 47.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.644 0.259 . . . . 73.510000000000005 110.477 -178.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 487' ' ' LEU . . . . . 0.43 HD11 ' HD3' ' A' ' 485' ' ' LYS . 5.1 mp -131.44 150.96 51.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.355 0.598 . . . . 53.549999999999997 111.194 -179.492 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.585 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 5.8 tmmm? -129.6 107.78 9.71 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.95 -1.023 . . . . 73.310000000000002 108.517 173.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.93 35.28 26.16 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.036 -0.529 . . . . 74.239999999999995 111.328 -176.399 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 95.96 -20.91 47.85 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.952 -0.642 . . . . 75.209999999999994 112.735 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 62.1 t -85.02 122.84 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 110.225 -0.287 . . . . 74.549999999999997 110.225 -177.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -69.06 132.18 46.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.344 -0.389 . . . . 75.409999999999997 110.651 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 79.9 mt -87.11 104.72 16.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.83 -0.623 . . . . 51.229999999999997 110.07 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 9.7 t -69.64 160.94 30.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.304 0.573 . . . . 63.420000000000002 111.206 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 495' ' ' ARG . . . . . 0.606 ' HA ' HG23 ' A' ' 498' ' ' THR . 0.0 OUTLIER -117.84 -3.45 11.21 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.624 -0.717 . . . . 75.299999999999997 109.5 179.689 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -60.82 -39.18 88.01 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.253 -0.885 . . . . 61.140000000000001 110.397 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 497' ' ' GLU . . . . . 0.423 ' O ' ' HG3' ' A' ' 497' ' ' GLU . 8.1 pt-20 -127.55 108.26 10.64 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.101 -0.704 . . . . 62.200000000000003 109.101 167.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.606 HG23 ' HA ' ' A' ' 495' ' ' ARG . 0.7 OUTLIER -122.29 88.0 2.85 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.389 0.614 . . . . 64.5 111.235 -176.593 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -100.91 -27.4 13.33 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.42 -0.809 . . . . 62.140000000000001 109.078 175.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -95.43 -47.32 6.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.208 -0.906 . . . . 65.329999999999998 111.026 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.455 ' O ' ' HD2' ' A' ' 502' ' ' ARG . 13.8 m-85 -103.21 148.41 25.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.2 -0.455 . . . . 74.310000000000002 110.622 -176.089 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 502' ' ' ARG . . . . . 0.455 ' HD2' ' O ' ' A' ' 501' ' ' TYR . 1.5 mpt_? -132.58 137.69 47.17 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.558 -0.534 . . . . 75.329999999999998 109.558 171.138 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -111.94 118.55 35.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.654 0.264 . . . . 72.150000000000006 110.799 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 1.4 mptm? -111.83 145.37 39.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.68 0.276 . . . . 72.129999999999995 110.354 176.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -123.35 117.57 25.52 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.318 -0.401 . . . . 62.409999999999997 110.787 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 506' ' ' ASP . . . . . 0.472 ' HB2' ' HG3' ' A' ' 509' ' ' ARG . 42.2 m-20 -121.27 77.7 1.35 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.631 -0.507 . . . . 73.230000000000004 109.631 173.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 64.84 -109.26 2.75 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.648 -0.786 . . . . 43.409999999999997 112.034 -178.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -85.91 -24.66 26.52 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.769 -0.254 . . . . 71.010000000000005 111.091 -177.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.608 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 29.6 ptt180 -92.95 132.41 37.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.616 0.722 . . . . 54.210000000000001 110.93 -177.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -114.94 143.98 44.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.519 -0.764 . . . . 72.439999999999998 109.28 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 511' ' ' HIS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 25.6 m-70 -119.22 127.62 53.44 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.844 -0.343 . . . . 71.140000000000001 110.803 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.412 HD11 ' HB3' ' A' ' 501' ' ' TYR . 65.4 tp -107.03 102.94 12.25 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.363 -0.977 . . . . 70.420000000000002 108.363 168.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.625 HD13 ' HG2' ' A' ' 472' ' ' GLU . 5.8 tp -103.47 115.46 45.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.518 0.675 . . . . 63.200000000000003 110.242 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.52 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 34.0 mt -95.27 112.74 28.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.631 -0.713 . . . . 53.210000000000001 109.221 177.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -73.76 -43.12 59.97 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.076 0.465 . . . . 73.340000000000003 110.048 -176.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -128.67 108.54 10.57 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.548 -0.751 . . . . 73.209999999999994 109.519 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.403 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -91.48 138.23 31.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.109 -0.496 . . . . 53.140000000000001 110.25 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 26.5 mmt -118.84 175.18 5.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.203 -0.453 . . . . 61.210000000000001 110.012 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.414 HD22 ' H ' ' A' ' 519' ' ' LEU . 3.0 mm? -64.99 -53.91 38.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.34 -0.391 . . . . 64.340000000000003 111.089 -173.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -80.01 -18.5 50.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.128 0.49 . . . . 73.109999999999999 110.716 -178.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.29 -33.34 71.45 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.048 -0.524 . . . . 64.25 111.755 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.554 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -64.4 -44.5 91.08 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.865 0.32 . . . . 71.109999999999999 111.865 -175.435 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 523' ' ' GLY . . . . . 0.585 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 40.47 -157.55 0.03 OUTLIER Glycine 0 CA--C 1.525 0.673 0 O-C-N 123.911 0.757 . . . . 43.219999999999999 114.818 175.032 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 53.7 m80 -105.88 112.45 25.51 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.471 -0.937 . . . . 72.420000000000002 108.471 169.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -85.45 131.45 34.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.259 0.552 . . . . 71.439999999999998 111.262 -175.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.28 131.42 34.4 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.301 -0.863 . . . . 75.120000000000005 110.558 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.6 HD11 ' HB ' ' A' ' 484' ' ' VAL . 37.3 tp -99.62 115.16 28.77 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.438 -0.578 . . . . 74.230000000000004 109.438 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 528' ' ' CYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 485' ' ' LYS . 48.4 t -100.16 112.87 25.2 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.702 -0.481 . . . . 74.329999999999998 109.702 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.522 ' C ' ' H ' ' A' ' 531' ' ' GLY . 61.2 p -111.51 -165.0 0.95 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.886 -0.597 . . . . 70.299999999999997 110.625 -178.134 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 11.9 m -51.09 6.06 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.611 1.164 . . . . 73.5 113.961 171.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 531' ' ' GLY . . . . . 0.522 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.42 28.88 1.54 Allowed Glycine 0 C--N 1.332 0.348 0 O-C-N 121.952 -0.467 . . . . 53.340000000000003 113.253 -175.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -113.4 141.76 17.1 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 109.974 -1.25 . . . . 74.319999999999993 109.974 167.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -128.84 121.96 29.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.461 0.63 . . . . 63.109999999999999 112.096 -173.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -131.14 132.16 44.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.581 -0.736 . . . . 55.130000000000003 109.274 170.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -118.81 124.38 47.05 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.032 -0.358 . . . . 61.109999999999999 110.032 -176.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.694 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -118.69 159.13 24.2 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.136 -0.484 . . . . 52.310000000000002 110.215 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -127.36 123.12 35.51 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.92 0.391 . . . . 72.129999999999995 110.815 -176.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 464' ' ' LEU . 54.8 tp -112.12 121.48 45.08 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.878 -0.601 . . . . 75.219999999999999 109.723 176.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.658 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.5 mp -108.26 107.66 23.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 109.016 -0.735 . . . . 74.540000000000006 109.016 176.045 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 465' ' ' VAL . 42.2 t -94.79 122.82 46.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.32 0.581 . . . . 74.319999999999993 110.37 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 541' ' ' GLN . . . . . 0.474 ' HB3' ' HE3' ' A' ' 543' ' ' LYS . 58.3 mt-30 -114.64 160.54 19.21 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.98 -1.009 . . . . 74.310000000000002 110.166 -176.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 542' ' ' GLU . . . . . 0.419 ' HG2' HG21 ' A' ' 467' ' ' VAL . 46.6 mt-10 -105.95 106.76 17.42 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.949 -0.76 . . . . 64.439999999999998 108.949 174.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 543' ' ' LYS . . . . . 0.474 ' HE3' ' HB3' ' A' ' 541' ' ' GLN . 17.2 ptpt . . . . . 0 C--O 1.245 0.854 0 CA-C-N 116.293 -0.412 . . . . 42.340000000000003 110.137 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo . . . . . 0 N--CA 1.454 -0.83 0 N-CA-C 109.656 -0.94 . . . . 74.409999999999997 109.656 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.538 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 55.1 t -68.52 106.69 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 120.889 0.376 . . . . 53.340000000000003 110.158 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 52.6 tp -87.64 138.75 31.2 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.943 -0.571 . . . . 73.400000000000006 110.348 -178.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.479 HD13 HD23 ' A' ' 527' ' ' LEU . 32.7 mt -91.75 113.3 26.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.563 -0.744 . . . . 71.230000000000004 109.458 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 457' ' ' THR . . . . . 0.453 ' OG1' ' HB2' ' A' ' 476' ' ' GLU . 28.6 p -77.29 -45.86 24.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.929 0.395 . . . . 74.030000000000001 110.808 -176.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.46 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 12.1 tpt180 -92.1 111.03 48.09 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.994 -0.548 . . . . 61.329999999999998 109.857 176.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -68.81 149.67 73.01 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.491 2.127 . . . . 65.140000000000001 111.109 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.781 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 4.0 mm? -66.2 158.94 27.51 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.316 -0.402 . . . . 75.420000000000002 110.792 -178.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 461' ' ' GLU . . . . . 0.528 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 1.8 mp0 -65.12 144.41 57.25 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.97 0.891 . . . . 44.25 112.709 -172.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -104.77 9.13 35.07 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.049 -1.432 . . . . 74.329999999999998 111.729 -174.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 463' ' ' GLN . . . . . 0.505 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -121.44 154.36 36.65 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 122.214 1.006 . . . . 73.409999999999997 112.894 -160.256 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.494 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.1 pt? -90.86 147.08 23.41 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 113.4 -1.727 . . . . 64.310000000000002 112.206 -167.144 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.556 HG23 HG22 ' A' ' 540' ' ' VAL . 27.4 m -126.68 178.0 4.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.45 -0.795 . . . . 71.420000000000002 110.076 175.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 466' ' ' MET . . . . . 0.405 ' HB3' ' HG3' ' A' ' 543' ' ' LYS . 51.4 mtm -118.16 158.65 24.69 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.245 -0.434 . . . . 64.25 110.82 -178.008 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 51.4 t -50.95 128.6 8.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.653 -0.703 . . . . 72.120000000000005 111.72 -176.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 89.39 -16.04 57.06 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 115.838 -0.619 . . . . 72.049999999999997 113.337 174.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -83.17 135.09 34.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 117.038 0.419 . . . . 74.549999999999997 110.792 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 470' ' ' ARG . . . . . 0.538 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 2.0 ptm180 -66.33 126.52 29.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.63 -0.714 . . . . 70.299999999999997 110.61 175.611 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.506 ' HB ' HG11 ' A' ' 465' ' ' VAL . 5.2 p -113.16 137.94 44.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.749 -0.463 . . . . 72.340000000000003 109.749 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.467 ' HB2' ' NH2' ' A' ' 470' ' ' ARG . 30.4 tt0 -120.49 124.02 44.39 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.785 -0.643 . . . . 72.319999999999993 110.515 -173.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.528 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 97.4 m-85 -110.28 141.07 43.78 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.905 -0.589 . . . . 71.129999999999995 109.557 176.586 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -119.2 134.97 54.9 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.903 0.382 . . . . 73.010000000000005 110.234 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 27.1 p -146.93 126.55 13.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.368 -0.378 . . . . 61.219999999999999 110.392 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.46 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 31.4 mt-10 -110.77 137.66 48.14 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.82 -0.807 . . . . 75.030000000000001 108.82 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 508' ' ' GLN . 27.8 m -119.48 152.63 22.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 C-N-CA 120.562 -0.455 . . . . 71.430000000000007 110.653 177.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 16.1 m -66.68 -26.04 66.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.66 -0.7 . . . . 61.450000000000003 111.718 -175.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 479' ' ' GLU . . . . . 0.423 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 37.8 tt0 -106.42 118.18 35.98 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.865 -0.42 . . . . 70.530000000000001 109.865 -178.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 480' ' ' GLU . . . . . 0.826 ' HB3' ' HG2' ' A' ' 508' ' ' GLN . 10.0 pt-20 -76.19 134.34 39.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.093 0.473 . . . . 73.450000000000003 110.893 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 72.68 21.18 79.78 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.696 -0.684 . . . . 63.5 112.092 -176.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.423 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -73.28 150.84 41.64 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.88 0.372 . . . . 74.299999999999997 111.452 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -81.72 114.53 20.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.551 -0.75 . . . . 52.020000000000003 110.438 178.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.582 HG12 HG22 ' A' ' 529' ' ' THR . 21.2 m -125.84 150.64 31.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 70.450000000000003 109.862 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 485' ' ' LYS . . . . . 0.508 ' HE2' HD11 ' A' ' 487' ' ' LEU . 21.0 ptmt -125.61 140.44 52.73 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.065 0.459 . . . . 74.230000000000004 110.749 177.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -102.01 125.78 48.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.621 -0.718 . . . . 72.219999999999999 110.222 -179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 487' ' ' LEU . . . . . 0.508 HD11 ' HE2' ' A' ' 485' ' ' LYS . 5.7 mp -114.13 136.4 52.98 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.063 -0.517 . . . . 55.009999999999998 110.379 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.15 105.46 12.62 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.813 -1.181 . . . . 72.140000000000001 107.813 174.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 57.12 34.04 24.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.993 -0.549 . . . . 64.450000000000003 110.691 -174.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.25 -18.88 56.65 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.001 -0.619 . . . . 44.340000000000003 112.906 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 45.5 t -83.09 127.45 39.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 110.328 -0.249 . . . . 50.130000000000003 110.328 -178.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -72.24 126.56 30.12 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.47 -0.567 . . . . 73.409999999999997 109.47 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.472 HD11 ' HE2' ' A' ' 525' ' ' TYR . 77.3 mt -66.04 106.43 1.61 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.141 0.496 . . . . 74.219999999999999 110.641 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 9.8 t -73.45 141.52 46.87 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 115.586 -0.734 . . . . 74.25 110.751 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 495' ' ' ARG . . . . . 0.466 ' HD3' ' N ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -107.7 13.12 26.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.694 -0.685 . . . . 73.129999999999995 110.264 -179.04 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -59.96 -56.61 19.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.8 -0.637 . . . . 60.340000000000003 109.644 174.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -137.78 118.39 13.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.729 -0.668 . . . . 75.400000000000006 109.913 173.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.2 108.56 5.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.076 -0.511 . . . . 72.209999999999994 110.42 -178.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -104.47 -22.22 13.33 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.284 0.564 . . . . 74.230000000000004 110.098 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -92.87 -34.47 13.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.744 -0.662 . . . . 73.109999999999999 111.611 -177.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.412 ' HD1' HG12 ' A' ' 514' ' ' ILE . 8.0 m-85 -115.77 141.51 48.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.617 -0.265 . . . . 73.030000000000001 110.309 -174.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -132.52 126.42 32.86 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.87 0.366 . . . . 74.209999999999994 110.128 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -96.43 113.63 25.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.803 -0.635 . . . . 71.310000000000002 110.819 -174.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 42.1 mttm -109.64 124.41 51.13 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.101 -0.5 . . . . 60.030000000000001 111.246 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -103.92 111.15 23.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.022 -0.535 . . . . 75.310000000000002 109.984 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 506' ' ' ASP . . . . . 0.401 ' O ' ' HG2' ' A' ' 509' ' ' ARG . 4.9 m-20 -120.03 87.09 2.68 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.124 0.488 . . . . 72.510000000000005 110.2 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 63.4 -105.51 1.08 Allowed Glycine 0 N--CA 1.449 -0.448 0 CA-C-N 115.638 -0.71 . . . . 71.420000000000002 112.843 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.826 ' HG2' ' HB3' ' A' ' 480' ' ' GLU . 66.8 mt-30 -93.1 -25.18 18.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.767 0.318 . . . . 65.099999999999994 110.871 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.401 ' HG2' ' O ' ' A' ' 506' ' ' ASP . 16.9 ptp180 -96.43 153.4 17.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.352 0.596 . . . . 73.230000000000004 111.002 -175.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -127.1 123.06 35.98 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.72 -0.673 . . . . 64.310000000000002 109.268 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 511' ' ' HIS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 56.3 m-70 -101.52 118.3 36.67 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.989 -0.374 . . . . 71.209999999999994 109.989 -177.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 61.5 tp -104.29 106.69 17.28 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.265 -0.642 . . . . 74.430000000000007 109.265 173.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 9.2 tp -104.92 128.77 58.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.992 -0.549 . . . . 75.140000000000001 110.133 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 34.2 mt -104.54 114.3 43.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.204 -0.665 . . . . 53.25 109.204 175.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -58.23 -52.64 64.74 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.547 0.529 . . . . 44.509999999999998 111.435 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -137.74 109.64 7.17 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.722 -0.473 . . . . 73.349999999999994 109.722 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -76.19 127.38 32.8 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.953 -0.567 . . . . 71.019999999999996 111.238 -178.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 14.9 mmt -97.51 175.43 6.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.836 -0.62 . . . . 60.149999999999999 109.678 176.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.2 -53.36 25.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.952 0.406 . . . . 72.349999999999994 110.805 -178.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -71.32 -27.89 63.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.072 -0.513 . . . . 73.109999999999999 111.034 -177.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -77.83 -3.44 41.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.516 -0.766 . . . . 52.32 111.857 -173.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.55 ' HA ' HD23 ' A' ' 538' ' ' LEU . . . -74.37 -43.2 57.54 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.498 -0.481 . . . . 52.5 109.918 177.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 38.28 -158.55 0.01 OUTLIER Glycine 0 C--N 1.339 0.734 0 O-C-N 124.457 1.098 . . . . 44.299999999999997 115.557 172.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -114.05 108.86 17.57 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.307 -0.627 . . . . 73.519999999999996 109.307 169.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 525' ' ' TYR . . . . . 0.472 ' HE2' HD11 ' A' ' 493' ' ' LEU . 32.1 m-85 -85.63 133.86 34.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.964 0.411 . . . . 73.409999999999997 111.087 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -134.35 128.78 34.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.924 -0.58 . . . . 64.439999999999998 110.545 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.479 HD23 HD13 ' A' ' 456' ' ' ILE . 63.4 tp -99.86 111.98 24.27 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.84 -0.43 . . . . 73.519999999999996 109.84 176.535 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 70.8 m -104.79 126.08 51.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.299 0.571 . . . . 55.25 110.914 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.582 HG22 HG12 ' A' ' 484' ' ' VAL . 30.1 p -115.79 -165.52 1.05 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.341 -0.845 . . . . 72.409999999999997 110.119 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 530' ' ' SER . . . . . 0.466 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 14.7 m -50.77 7.43 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.859 1.264 . . . . 73.319999999999993 114.173 171.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 531' ' ' GLY . . . . . 0.535 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 122.14 28.18 1.55 Allowed Glycine 0 C--N 1.331 0.266 0 O-C-N 122.007 -0.433 . . . . 54.329999999999998 113.245 -174.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -117.76 138.37 13.96 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.603 -1.399 . . . . 12.41 109.603 163.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -129.35 127.92 42.04 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 117.463 0.632 . . . . 73.310000000000002 112.103 -171.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -136.62 136.45 39.18 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.485 -0.78 . . . . 74.109999999999999 109.551 171.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 33.3 tp -109.09 145.24 36.0 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.817 0.341 . . . . 62.210000000000001 111.029 -176.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.781 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -123.72 132.46 53.82 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.092 -0.504 . . . . 71.439999999999998 110.324 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -110.41 115.92 30.51 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.77 -0.456 . . . . 71.340000000000003 109.77 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.555 HD11 HG22 ' A' ' 465' ' ' VAL . 35.7 tp -108.64 121.07 44.25 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.058 -0.519 . . . . 75.109999999999999 109.723 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 539' ' ' ILE . 4.5 mp -109.98 116.64 52.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.228 -0.656 . . . . 73.129999999999995 109.228 177.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.556 HG22 HG23 ' A' ' 465' ' ' VAL . 90.1 t -114.1 128.44 71.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.92 0.391 . . . . 72.019999999999996 110.257 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.46 169.65 14.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.048 -0.524 . . . . 62.340000000000003 109.894 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.53 141.31 39.67 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.532 -0.758 . . . . 72.319999999999993 110.642 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 543' ' ' LYS . . . . . 0.449 ' HE3' ' HB2' ' A' ' 543' ' ' LYS . 33.2 mtmt . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.398 -0.811 . . . . 72.200000000000003 110.033 176.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.448 -1.205 0 N-CA-C 110.391 -0.657 . . . . 73.109999999999999 110.391 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.554 ' HB ' ' HB ' ' A' ' 529' ' ' THR . 58.5 t -78.18 107.35 10.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 108.979 -0.749 . . . . 62.119999999999997 108.979 178.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 455' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 477' ' ' VAL . 62.0 tp -84.91 124.17 31.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.733 -0.667 . . . . 73.319999999999993 110.753 -173.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.524 HD13 HD23 ' A' ' 527' ' ' LEU . 29.3 mt -91.01 98.9 8.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.71 -0.677 . . . . 72.420000000000002 109.998 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 33.8 p -79.19 -16.04 57.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 72.439999999999998 111.088 -176.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.474 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 19.2 tpt85 -130.38 102.03 17.21 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.904 -0.589 . . . . 72.439999999999998 109.717 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 459' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 458' ' ' ARG . 29.7 Cg_endo -63.62 167.73 12.89 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 123.224 2.616 . . . . 74.400000000000006 112.078 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.799 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 3.2 mm? -71.1 172.59 8.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.077 -0.51 . . . . 73.409999999999997 110.906 -177.155 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 461' ' ' GLU . . . . . 0.906 ' HG2' ' HA ' ' A' ' 473' ' ' PHE . 13.5 mm-40 -67.78 152.8 45.0 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.787 -0.642 . . . . 71.329999999999998 112.488 -176.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -105.53 6.51 32.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.315 -0.857 . . . . 70.430000000000007 112.454 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.7 154.53 39.29 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.89 0.852 . . . . 71.439999999999998 113.008 -162.133 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.653 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.0 pt? -103.9 146.84 28.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.185 -1.37 . . . . 74.519999999999996 111.808 -170.12 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.567 HG11 ' HB ' ' A' ' 471' ' ' VAL . 27.5 m -123.71 178.87 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-O 121.079 0.466 . . . . 44.310000000000002 111.265 -177.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 10.4 mtm -112.32 161.61 16.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.377 -0.374 . . . . 65.400000000000006 111.295 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 467' ' ' VAL . . . . . 0.48 HG21 ' HG2' ' A' ' 542' ' ' GLU . 59.6 t -56.72 129.67 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 115.955 -0.566 . . . . 52.350000000000001 112.178 -176.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 86.12 7.7 79.86 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.72 -0.673 . . . . 75.409999999999997 113.208 174.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -116.73 133.01 56.53 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.799 0.299 . . . . 63.350000000000001 110.306 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 470' ' ' ARG . . . . . 0.579 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 5.3 ptm180 -74.02 131.86 41.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.301 0.572 . . . . 72.5 112.1 -175.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.567 ' HB ' HG11 ' A' ' 465' ' ' VAL . 7.5 p -115.37 146.33 19.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.205 -0.907 . . . . 71.549999999999997 109.714 176.228 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -123.03 129.17 51.16 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.381 -0.229 . . . . 75.120000000000005 110.381 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.906 ' HA ' ' HG2' ' A' ' 461' ' ' GLU . 96.0 m-85 -106.45 124.89 50.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.437 -0.579 . . . . 74.450000000000003 109.437 174.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -100.25 131.48 46.16 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.085 -0.339 . . . . 73.030000000000001 110.085 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.452 ' HB3' HD13 ' A' ' 460' ' ' LEU . 18.2 p -141.4 118.05 10.98 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.091 0.472 . . . . 45.420000000000002 110.555 177.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.637 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 39.7 mt-10 -107.39 138.58 43.33 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.853 -0.612 . . . . 71.420000000000002 109.747 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 455' ' ' LEU . 28.2 m -132.57 174.06 13.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.297 -0.411 . . . . 71.120000000000005 110.767 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 16.7 p -85.77 8.37 20.2 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.482 0.549 . . . . 74.299999999999997 112.482 -175.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 479' ' ' GLU . . . . . 0.56 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 41.2 tt0 -126.82 134.83 50.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.6 0.238 . . . . 64.310000000000002 110.631 -177.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 480' ' ' GLU . . . . . 0.512 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 0.4 OUTLIER -81.83 128.27 33.85 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.555 -0.535 . . . . 73.230000000000004 109.555 179.15 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 60.27 32.79 77.89 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.165 -1.017 . . . . 62.549999999999997 110.879 -171.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.56 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -50.71 141.67 12.5 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 113.145 0.794 . . . . 75.510000000000005 113.145 -174.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 12.3 mp0 -74.79 103.7 5.14 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.126 -0.943 . . . . 73.299999999999997 109.813 175.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.559 HG12 HG22 ' A' ' 529' ' ' THR . 34.3 m -121.51 150.11 24.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.931 -0.577 . . . . 73.219999999999999 110.836 -177.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 47.1 tttp -123.27 126.86 47.7 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.213 -0.662 . . . . 73.209999999999994 109.213 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 486' ' ' TRP . . . . . 0.461 ' HB3' HD12 ' A' ' 493' ' ' LEU . 95.3 m95 -101.39 125.29 48.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.605 -0.27 . . . . 62.119999999999997 110.638 -177.475 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 487' ' ' LEU . . . . . 0.441 HD13 ' SG ' ' A' ' 528' ' ' CYS . 6.5 mp -128.12 144.07 51.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.065 0.459 . . . . 75.409999999999997 110.77 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.481 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 5.8 tmmm? -124.19 106.78 10.58 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.363 -0.977 . . . . 65.140000000000001 108.363 174.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 52.21 36.01 18.23 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.749 0.656 . . . . 73.239999999999995 111.693 -175.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.02 -20.07 51.73 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.869 -0.681 . . . . 34.009999999999998 112.921 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 43.4 t -86.64 123.79 39.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 110.092 -0.336 . . . . 63.439999999999998 110.092 -179.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -70.6 134.28 47.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.094 0.473 . . . . 70.030000000000001 110.804 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.461 HD12 ' HB3' ' A' ' 486' ' ' TRP . 52.2 mt -82.73 103.22 12.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.767 -0.651 . . . . 74.519999999999996 109.411 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 7.0 t -65.15 145.52 56.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 73.099999999999994 111.631 -177.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.62 9.5 17.88 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.149 -0.932 . . . . 70.219999999999999 109.482 176.171 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.32 -44.41 16.24 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.723 -0.671 . . . . 72.200000000000003 110.04 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 497' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 497' ' ' GLU . 7.0 pt-20 -143.16 110.08 5.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.314 0.578 . . . . 73.329999999999998 109.573 171.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.544 HG21 ' HB2' ' A' ' 501' ' ' TYR . 0.3 OUTLIER -142.76 109.54 5.47 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.231 0.539 . . . . 61.350000000000001 111.381 -177.072 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -89.88 -7.54 53.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.616 -0.72 . . . . 72.019999999999996 110.871 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 500' ' ' LYS . . . . . 0.414 ' CG ' ' HB2' ' A' ' 516' ' ' GLU . 3.4 mtmm -114.4 -48.75 2.86 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.048 -0.524 . . . . 64.439999999999998 112.054 -173.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.544 ' HB2' HG21 ' A' ' 498' ' ' THR . 57.2 m-85 -93.04 126.77 38.29 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.813 -0.44 . . . . 72.430000000000007 109.813 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 502' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' A' ' 502' ' ' ARG . 1.2 tpt180 -117.09 123.11 45.99 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.234 -0.654 . . . . 63.240000000000002 109.234 177.403 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -104.13 117.46 34.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.236 -0.438 . . . . 64.5 110.228 -174.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 57.2 mttm -114.35 131.56 56.51 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.35 -0.386 . . . . 54.020000000000003 110.576 -178.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -103.9 118.27 36.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.196 -0.456 . . . . 73.140000000000001 110.687 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -120.42 89.92 3.22 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.104 -0.498 . . . . 62.450000000000003 110.016 174.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 61.68 -101.45 0.35 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.637 -0.71 . . . . 74.519999999999996 112.518 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.512 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 26.5 mt-30 -98.88 -20.23 16.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.524 0.202 . . . . 74.519999999999996 111.376 -177.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.637 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 14.7 ptt180 -101.04 153.54 19.46 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.333 0.587 . . . . 73.450000000000003 111.585 -175.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -121.99 141.37 51.41 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.424 -0.807 . . . . 75.530000000000001 109.494 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 511' ' ' HIS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 15.3 m-70 -110.6 133.26 53.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 110.02 -0.363 . . . . 64.019999999999996 110.02 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 66.6 tp -107.51 104.19 13.69 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.739 -0.467 . . . . 64.319999999999993 109.739 172.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.483 HD13 ' HD2' ' A' ' 504' ' ' LYS . 1.9 mp -100.91 127.7 53.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.065 -0.516 . . . . 53.329999999999998 110.092 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.579 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 53.7 mt -108.1 112.37 39.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.743 -0.466 . . . . 73.329999999999998 109.743 174.709 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -72.44 -44.45 62.37 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.195 -0.457 . . . . 45.43 111.144 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 516' ' ' GLU . . . . . 0.414 ' HB2' ' CG ' ' A' ' 500' ' ' LYS . 31.8 mt-10 -116.2 107.52 14.99 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.591 -0.522 . . . . 60.329999999999998 109.591 -178.6 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -94.2 113.21 25.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.383 -0.371 . . . . 61.450000000000003 110.47 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 518' ' ' MET . . . . . 0.453 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 25.0 mmt -110.7 164.8 12.39 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.166 -0.47 . . . . 62.439999999999998 110.281 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.541 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.1 mm? -61.37 -55.41 31.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 72.049999999999997 111.529 -172.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -82.99 -8.04 59.6 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.104 -0.498 . . . . 74.239999999999995 111.528 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 521' ' ' ASP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 9.2 t70 -82.28 -27.26 32.48 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.312 -0.404 . . . . 70.109999999999999 110.521 -175.524 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.677 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -63.27 -41.73 99.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 73.400000000000006 111.614 -177.1 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 523' ' ' GLY . . . . . 0.481 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 42.48 -158.2 0.07 OUTLIER Glycine 0 CA--C 1.526 0.742 0 O-C-N 123.783 0.677 . . . . 51.299999999999997 114.422 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -109.6 115.69 30.36 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.007 -0.738 . . . . 65.140000000000001 109.007 172.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -89.48 131.67 35.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.349 0.595 . . . . 73.349999999999994 111.145 -176.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.94 125.48 33.55 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.434 -0.803 . . . . 71.530000000000001 110.186 178.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.559 HD11 ' HB ' ' A' ' 484' ' ' VAL . 44.6 tp -92.55 112.32 24.23 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.478 -0.564 . . . . 51.329999999999998 109.478 177.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 528' ' ' CYS . . . . . 0.441 ' SG ' HD13 ' A' ' 487' ' ' LEU . 62.2 m -107.42 114.89 29.2 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.882 -0.599 . . . . 74.019999999999996 110.321 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.571 ' C ' ' H ' ' A' ' 531' ' ' GLY . 72.2 p -109.89 -165.39 1.0 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.054 -0.521 . . . . 73.230000000000004 109.874 178.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 530' ' ' SER . . . . . 0.464 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 20.3 m -48.6 6.65 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.742 1.217 . . . . 64.25 114.18 171.405 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 531' ' ' GLY . . . . . 0.571 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.44 26.62 1.95 Allowed Glycine 0 N--CA 1.451 -0.356 0 O-C-N 122.092 -0.38 . . . . 63.200000000000003 112.949 -176.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -110.45 144.38 17.08 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 109.406 -1.477 . . . . 64.239999999999995 109.406 163.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.58 132.39 48.21 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 117.83 0.815 . . . . 73.150000000000006 111.613 -171.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -141.12 128.59 21.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.697 -0.683 . . . . 62.350000000000001 109.451 172.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.425 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.7 tm? -114.8 131.95 56.64 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 110.101 -0.333 . . . . 62.549999999999997 110.101 -174.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.799 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -128.95 158.17 39.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.53 -0.305 . . . . 71.040000000000006 110.583 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -131.9 117.49 18.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.533 -0.303 . . . . 54.43 110.19 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.513 HD11 HG22 ' A' ' 465' ' ' VAL . 37.3 tp -106.1 128.71 54.07 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.979 -0.555 . . . . 74.200000000000003 109.831 178.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.653 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.3 mp -117.89 108.7 25.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 109.365 -0.605 . . . . 64.430000000000007 109.365 177.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.677 HG23 ' HB2' ' A' ' 522' ' ' ALA . 66.9 t -90.64 132.37 35.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.784 -0.45 . . . . 51.439999999999998 109.784 178.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -120.89 157.9 28.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.815 -0.63 . . . . 73.230000000000004 110.333 -175.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 542' ' ' GLU . . . . . 0.541 ' HG3' HD11 ' A' ' 519' ' ' LEU . 39.0 mt-10 -107.9 117.77 35.0 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.967 -0.561 . . . . 64.319999999999993 110.38 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 543' ' ' LYS . . . . . 0.877 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 9.6 mmpt? . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.31 -0.852 . . . . 52.43 109.58 171.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo . . . . . 0 N--CA 1.456 -0.721 0 N-CA-C 111.136 -0.371 . . . . 71.230000000000004 111.136 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.476 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 83.0 t -67.08 111.51 2.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.064 0.459 . . . . 71.099999999999994 110.065 178.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 60.1 tp -91.22 148.63 22.22 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.498 -0.773 . . . . 62.399999999999999 110.344 -176.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.541 HD13 HD23 ' A' ' 527' ' ' LEU . 25.2 mt -94.79 99.52 9.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.232 -0.655 . . . . 65.299999999999997 109.232 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 12.5 p -70.02 -34.51 73.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.006 -0.543 . . . . 73.329999999999998 110.904 -176.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 458' ' ' ARG . 3.1 tpp180 -116.77 105.52 49.6 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 116.03 -0.532 . . . . 72.239999999999995 109.937 174.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -66.55 168.86 15.45 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.193 2.595 . . . . 74.120000000000005 111.254 175.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.67 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 2.5 mm? -65.0 153.59 40.22 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.811 -0.44 . . . . 62.299999999999997 109.811 -178.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 461' ' ' GLU . . . . . 0.434 ' HB3' HE22 ' A' ' 463' ' ' GLN . 2.6 tp10 -66.37 152.99 43.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.412 0.625 . . . . 71.439999999999998 111.652 -170.044 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -92.02 9.01 35.03 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.816 1.043 . . . . 73.310000000000002 113.816 -167.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 463' ' ' GLN . . . . . 0.434 HE22 ' HB3' ' A' ' 461' ' ' GLU . 0.0 OUTLIER -123.13 153.86 39.41 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.572 -0.851 . . . . 75.219999999999999 112.109 -166.37 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.72 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.3 pt? -118.02 144.9 45.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.291 -1.322 . . . . 62.130000000000003 110.798 -170.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.401 HG11 ' HB ' ' A' ' 471' ' ' VAL . 31.2 m -117.71 177.64 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.225 0.536 . . . . 61.520000000000003 112.131 -174.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.81 171.12 9.07 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.543 -0.753 . . . . 50.509999999999998 110.707 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 467' ' ' VAL . . . . . 0.553 HG21 ' HG2' ' A' ' 542' ' ' GLU . 46.8 t -59.67 125.81 16.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.211 -0.449 . . . . 51.109999999999999 111.32 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 81.96 3.4 90.59 Favored Glycine 0 CA--C 1.517 0.201 0 CA-C-N 115.889 -0.596 . . . . 63.100000000000001 113.065 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -96.01 136.99 35.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.752 0.311 . . . . 74.140000000000001 110.608 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 470' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 1.5 ptm180 -66.84 146.69 54.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.824 -0.625 . . . . 74.319999999999993 111.377 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.401 ' HB ' HG11 ' A' ' 465' ' ' VAL . 7.7 p -147.38 137.94 17.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.579 -0.737 . . . . 72.219999999999999 109.643 175.447 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.52 ' HG3' HG13 ' A' ' 513' ' ' ILE . 13.0 mp0 -107.68 130.96 54.88 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.871 0.367 . . . . 63.32 110.559 178.228 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.588 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 57.8 m-85 -108.07 113.21 26.2 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.574 -0.528 . . . . 72.329999999999998 109.574 170.063 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -95.81 132.45 41.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.649 -0.705 . . . . 62.200000000000003 110.388 -176.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 458' ' ' ARG . 7.0 p -141.29 118.54 11.38 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.875 0.369 . . . . 73.200000000000003 110.613 177.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.993 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 23.4 mt-10 -112.16 138.24 49.12 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.527 -0.545 . . . . 62.439999999999998 109.527 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.492 HG21 ' HB3' ' A' ' 482' ' ' ALA . 26.2 m -122.6 173.12 8.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.578 -0.283 . . . . 64.400000000000006 111.304 -178.228 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 15.4 m -61.61 -36.27 80.26 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.152 0.797 . . . . 41.340000000000003 113.152 -175.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -119.72 156.25 30.89 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.421 -0.215 . . . . 72.099999999999994 110.421 -172.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 480' ' ' GLU . . . . . 0.483 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 0.1 OUTLIER -86.34 143.72 27.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.095 0.474 . . . . 62.43 110.563 -179.005 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 72.62 3.38 58.57 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.821 -0.704 . . . . 71.329999999999998 112.733 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.492 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -56.07 134.38 52.59 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.845 0.355 . . . . 73.430000000000007 110.959 -179.048 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -78.09 139.3 39.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.748 -0.66 . . . . 44.130000000000003 110.058 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.6 ' HB ' HD11 ' A' ' 527' ' ' LEU . 20.1 m -127.44 150.58 33.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.049 0.452 . . . . 72.299999999999997 110.875 -178.45 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 485' ' ' LYS . . . . . 0.552 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 65.4 tttp -108.2 122.09 46.2 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.608 -0.724 . . . . 73.319999999999993 109.378 179.342 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 486' ' ' TRP . . . . . 0.54 ' HB3' HD12 ' A' ' 493' ' ' LEU . 59.1 m95 -101.34 122.22 43.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.945 0.403 . . . . 75.319999999999993 110.623 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 487' ' ' LEU . . . . . 0.456 HD11 ' HE3' ' A' ' 485' ' ' LYS . 86.0 mt -130.15 139.08 50.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.865 -0.607 . . . . 63.039999999999999 111.34 -176.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.628 ' O ' HG12 ' A' ' 491' ' ' VAL . 3.7 tmmm? -115.3 106.52 14.13 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.085 -1.08 . . . . 73.310000000000002 108.085 168.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 51.79 34.37 13.06 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.162 -0.472 . . . . 63.030000000000001 111.253 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.42 -14.57 60.78 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.807 -0.711 . . . . 44.32 114.015 175.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 491' ' ' VAL . . . . . 0.628 HG12 ' O ' ' A' ' 488' ' ' LYS . 6.2 p -87.89 139.72 16.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-N 117.862 0.831 . . . . 51.030000000000001 110.559 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -66.59 124.18 22.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.986 -0.552 . . . . 75.200000000000003 111.567 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.54 HD12 ' HB3' ' A' ' 486' ' ' TRP . 94.1 mt -84.15 106.81 16.08 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.921 -0.77 . . . . 73.349999999999994 108.921 171.781 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 5.5 t -64.39 129.09 38.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.331 0.586 . . . . 74.430000000000007 111.656 -174.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.16 3.01 18.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.587 -0.733 . . . . 73.129999999999995 110.455 176.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -59.6 -54.27 48.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.099 -0.5 . . . . 72.019999999999996 109.954 173.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -149.34 111.62 4.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.609 -0.723 . . . . 53.450000000000003 109.833 174.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.448 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.2 OUTLIER -124.6 125.83 44.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.061 -0.518 . . . . 71.299999999999997 110.229 -178.119 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -94.81 -42.08 8.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.452 0.644 . . . . 73.400000000000006 110.17 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -80.17 -44.25 20.17 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.318 -0.856 . . . . 65.129999999999995 110.895 -173.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.448 ' O ' ' HB ' ' A' ' 498' ' ' THR . 5.1 m-85 -104.95 141.82 35.88 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.027 -0.731 . . . . 73.329999999999998 109.027 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 21.0 mtp180 -128.26 123.22 33.59 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.111 0.481 . . . . 65.420000000000002 109.742 176.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -94.77 127.8 41.03 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.634 -0.712 . . . . 74.319999999999993 110.368 -174.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.621 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 1.3 mptm? -114.4 144.85 42.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.421 -0.354 . . . . 54.340000000000003 110.679 177.318 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -116.24 130.35 56.74 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.051 -0.522 . . . . 65.409999999999997 109.823 177.138 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 506' ' ' ASP . . . . . 0.403 ' HB3' ' HG3' ' A' ' 509' ' ' ARG . 27.7 t70 -138.83 86.83 2.17 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.136 0.493 . . . . 75.200000000000003 110.06 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 63.7 -104.28 0.83 Allowed Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.899 -0.591 . . . . 52.109999999999999 112.551 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.483 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 21.6 mt-30 -95.43 -15.36 23.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.865 0.365 . . . . 73.510000000000005 110.797 -176.458 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.993 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 5.7 ptt180 -106.93 139.58 41.1 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.507 0.67 . . . . 73.25 111.786 -175.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -114.5 143.85 44.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.179 -0.919 . . . . 72.230000000000004 108.71 176.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 511' ' ' HIS . . . . . 0.621 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 84.6 m-70 -118.14 128.0 54.31 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.339 -0.245 . . . . 74.239999999999995 110.339 -177.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.588 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 57.7 tp -104.16 103.86 13.7 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.793 -0.447 . . . . 73.319999999999993 109.793 174.06 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.52 HG13 ' HG3' ' A' ' 472' ' ' GLU . 1.7 mp -98.23 118.93 45.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.025 -0.534 . . . . 74.230000000000004 110.217 177.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.48 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 62.2 mt -100.17 113.2 34.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.813 -0.63 . . . . 62.140000000000001 109.659 175.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -75.47 -46.98 29.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.102 0.477 . . . . 71.510000000000005 110.611 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -121.17 108.33 13.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.727 -0.67 . . . . 71.140000000000001 109.629 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.448 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -91.37 117.34 29.58 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.156 -0.475 . . . . 72.420000000000002 110.302 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 25.7 mmt -108.14 166.85 10.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.448 -0.342 . . . . 63.32 110.548 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.446 HD22 ' H ' ' A' ' 519' ' ' LEU . 3.3 mm? -57.73 -53.32 59.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 45.299999999999997 111.214 -174.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -77.69 -18.04 57.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.818 -0.628 . . . . 60.530000000000001 110.975 -175.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -80.17 -21.02 43.49 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.106 -0.497 . . . . 71.109999999999999 111.831 -174.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.664 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -63.36 -42.85 98.91 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.966 -0.293 . . . . 55.420000000000002 110.892 -177.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.23 -158.66 0.06 OUTLIER Glycine 0 C--N 1.335 0.498 0 CA-C-N 115.282 -0.872 . . . . 42.310000000000002 114.02 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 -118.98 108.64 15.0 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.087 -0.709 . . . . 75.409999999999997 109.087 170.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 525' ' ' TYR . . . . . 0.477 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 16.1 m-30 -85.19 132.81 34.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.084 -0.507 . . . . 74.5 111.186 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -134.89 119.25 17.84 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.539 -0.755 . . . . 64.409999999999997 109.641 176.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.6 HD11 ' HB ' ' A' ' 484' ' ' VAL . 40.9 tp -89.02 117.95 28.4 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.244 -0.434 . . . . 73.409999999999997 110.171 -177.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 528' ' ' CYS . . . . . 0.552 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 70.0 m -104.45 122.88 46.45 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.975 -0.557 . . . . 72.400000000000006 109.976 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.555 HG23 HG12 ' A' ' 484' ' ' VAL . 0.2 OUTLIER -116.54 -167.08 1.23 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.889 -0.596 . . . . 74.319999999999993 110.275 -175.724 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 530' ' ' SER . . . . . 0.454 ' H ' HG22 ' A' ' 529' ' ' THR . 9.9 m -52.11 7.4 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.418 1.487 . . . . 60.100000000000001 114.082 173.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 531' ' ' GLY . . . . . 0.546 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.14 26.73 1.99 Allowed Glycine 0 N--CA 1.452 -0.293 0 N-CA-C 111.69 -0.564 . . . . 73.120000000000005 111.69 -168.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -123.75 142.29 14.17 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 109.168 -1.573 . . . . 71.439999999999998 109.168 165.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.29 121.36 20.03 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 117.701 0.751 . . . . 73.209999999999994 110.694 -173.364 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -118.28 139.08 51.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.174 -0.466 . . . . 44.25 110.745 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.411 HD13 ' N ' ' A' ' 536' ' ' ALA . 3.0 tm? -106.61 134.96 48.96 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.568 -0.53 . . . . 72.310000000000002 109.568 -177.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.67 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -118.47 152.58 35.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.771 0.32 . . . . 55.509999999999998 111.242 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -117.19 116.18 26.77 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.119 -0.492 . . . . 74.319999999999993 109.901 175.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.548 HD23 ' HA ' ' A' ' 522' ' ' ALA . 28.1 tp -129.82 115.9 17.92 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.989 0.424 . . . . 64.109999999999999 109.878 175.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.479 ' HB ' ' CD1' ' A' ' 464' ' ' LEU . 62.0 mt -126.95 109.05 19.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.333 -0.617 . . . . 73.209999999999994 109.333 176.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.664 HG23 ' HB2' ' A' ' 522' ' ' ALA . 79.2 t -89.67 127.83 42.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 N-CA-C 109.284 -0.636 . . . . 50.340000000000003 109.284 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -126.65 144.3 50.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.848 -0.615 . . . . 61.140000000000001 110.855 -174.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 542' ' ' GLU . . . . . 0.553 ' HG2' HG21 ' A' ' 467' ' ' VAL . 37.7 mt-10 -89.2 109.95 20.76 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.115 -0.698 . . . . 71.450000000000003 109.115 173.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 58.1 pttt . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.539 -0.743 . . . . 73.019999999999996 109.961 -178.433 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.448 -1.165 0 N-CA-C 110.214 -0.725 . . . . 54.039999999999999 110.214 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.55 ' H ' ' HB2' ' A' ' 530' ' ' SER . 98.2 t -74.86 110.27 9.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.817 -0.438 . . . . 71.349999999999994 109.817 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 60.4 tp -79.49 129.95 34.95 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.624 -0.716 . . . . 63.439999999999998 110.151 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.501 HD13 HD23 ' A' ' 527' ' ' LEU . 42.3 mt -80.27 98.23 3.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.884 -0.784 . . . . 70.019999999999996 108.884 175.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 35.7 p -69.62 -39.45 77.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.627 -0.715 . . . . 64.0 111.382 -172.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.676 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 6.4 tpt180 -102.81 122.46 45.75 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.843 -0.617 . . . . 74.010000000000005 110.5 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.43 165.72 23.98 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.87 2.38 . . . . 73.349999999999994 112.294 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.542 ' CB ' ' HB2' ' A' ' 536' ' ' ALA . 4.1 mm? -80.26 172.01 14.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.129 -0.487 . . . . 74.409999999999997 111.408 -179.008 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 461' ' ' GLU . . . . . 0.557 ' HG3' ' OE1' ' A' ' 463' ' ' GLN . 0.3 OUTLIER -69.3 138.31 53.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.495 -0.775 . . . . 72.530000000000001 111.561 -175.64 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -104.97 8.56 34.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.983 -1.008 . . . . 70.340000000000003 113.321 -169.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 463' ' ' GLN . . . . . 0.557 ' OE1' ' HG3' ' A' ' 461' ' ' GLU . 0.2 OUTLIER -124.07 152.73 42.34 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 119.54 -0.864 . . . . 72.109999999999999 112.151 -168.709 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.585 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.3 pt? -100.4 146.43 27.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.495 -1.23 . . . . 73.519999999999996 111.433 -171.499 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.527 HG11 ' HB ' ' A' ' 471' ' ' VAL . 27.1 m -117.82 177.09 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.04 0.447 . . . . 71.340000000000003 110.508 175.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 466' ' ' MET . . . . . 0.405 ' HG2' ' HG3' ' A' ' 543' ' ' LYS . 37.7 mtm -118.18 159.77 22.73 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.001 -0.545 . . . . 74.549999999999997 110.135 -177.605 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 467' ' ' VAL . . . . . 0.512 HG21 ' HG2' ' A' ' 542' ' ' GLU . 64.8 t -55.27 124.33 8.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.004 0.43 . . . . 72.409999999999997 111.495 -174.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.41 -11.96 58.31 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.975 -0.631 . . . . 54.439999999999998 112.616 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -102.98 145.3 30.08 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.102 -0.333 . . . . 73.120000000000005 110.102 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 470' ' ' ARG . . . . . 0.504 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 5.4 ptp180 -86.76 135.1 33.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.268 0.556 . . . . 73.239999999999995 111.649 -177.082 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.527 ' HB ' HG11 ' A' ' 465' ' ' VAL . 7.1 p -119.1 133.96 64.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.622 -0.717 . . . . 54.229999999999997 110.019 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -115.44 127.9 55.66 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.507 -0.315 . . . . 64.109999999999999 110.176 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.46 ' HB3' HD12 ' A' ' 460' ' ' LEU . 96.5 m-85 -104.77 115.65 30.67 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.479 -0.563 . . . . 74.140000000000001 109.479 177.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.42 133.96 47.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.234 -0.439 . . . . 62.329999999999998 110.046 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 509' ' ' ARG . 20.9 p -149.41 147.56 28.42 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.194 -0.457 . . . . 73.340000000000003 110.681 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.676 ' HB2' ' HB3' ' A' ' 458' ' ' ARG . 49.1 mt-10 -123.07 138.75 54.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.839 0.352 . . . . 61.350000000000001 110.286 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.401 ' O ' ' HB3' ' A' ' 508' ' ' GLN . 18.6 m -113.11 163.3 10.44 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.928 -0.578 . . . . 74.239999999999995 109.742 174.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 11.5 t -60.67 -38.35 84.63 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.162 0.43 . . . . 45.130000000000003 112.162 -175.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 479' ' ' GLU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 6.6 tp10 -106.98 139.71 40.94 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.255 -0.276 . . . . 71.540000000000006 110.255 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.51 134.98 43.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.261 0.553 . . . . 73.120000000000005 111.157 -177.042 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 63.46 19.74 62.66 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.749 -0.66 . . . . 70.329999999999998 112.862 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.553 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -62.1 151.56 35.3 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.93 0.395 . . . . 74.209999999999994 111.077 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 483' ' ' GLN . . . . . 0.482 ' CD ' ' H ' ' A' ' 483' ' ' GLN . 3.4 pm0 -72.54 118.89 16.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.451 0.643 . . . . 75.140000000000001 110.912 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.634 HG12 HG23 ' A' ' 529' ' ' THR . 34.9 m -127.34 150.66 33.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.299 -0.864 . . . . 62.119999999999997 109.508 178.012 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 485' ' ' LYS . . . . . 0.562 ' HE2' ' HG3' ' A' ' 492' ' ' GLU . 83.6 tttt -128.31 136.33 50.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.768 0.318 . . . . 72.120000000000005 110.18 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 486' ' ' TRP . . . . . 0.563 ' HB3' HD12 ' A' ' 493' ' ' LEU . 90.1 m95 -102.15 125.92 48.97 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.971 0.415 . . . . 72.120000000000005 110.814 -176.813 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 487' ' ' LEU . . . . . 0.533 ' HG ' ' HA ' ' A' ' 492' ' ' GLU . 8.0 mp -126.32 159.53 32.88 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.926 -0.579 . . . . 61.409999999999997 110.068 176.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -141.15 116.97 10.39 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.448 -0.575 . . . . 74.329999999999998 109.448 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 57.82 34.14 24.04 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.511 0.507 . . . . 65.239999999999995 110.614 -175.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 81.98 -10.71 51.67 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.683 -0.689 . . . . 74.0 112.449 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 40.6 t -86.78 129.98 37.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.869 -0.419 . . . . 74.040000000000006 109.869 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 492' ' ' GLU . . . . . 0.562 ' HG3' ' HE2' ' A' ' 485' ' ' LYS . 33.1 tt0 -65.27 131.07 45.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.67 . . . . 65.430000000000007 110.259 -179.65 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.563 HD12 ' HB3' ' A' ' 486' ' ' TRP . 85.6 mt -85.54 118.24 24.93 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.945 -0.391 . . . . 71.219999999999999 109.945 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 5.1 t -67.18 145.85 54.82 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.571 -0.741 . . . . 75.099999999999994 111.161 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 495' ' ' ARG . . . . . 0.479 ' HD3' ' H ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -120.44 16.09 12.12 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.14 -0.689 . . . . 75.420000000000002 109.14 175.047 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -76.98 -60.97 2.14 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.231 -0.895 . . . . 64.430000000000007 109.578 176.673 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 497' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 497' ' ' GLU . 0.8 OUTLIER -105.31 106.56 17.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.286 0.565 . . . . 74.239999999999995 109.899 174.595 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.487 HG21 ' HE1' ' A' ' 503' ' ' PHE . 2.8 p -136.73 87.62 2.3 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.392 0.615 . . . . 73.030000000000001 111.505 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -105.8 -26.69 11.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.597 -0.729 . . . . 63.100000000000001 109.339 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 500' ' ' LYS . . . . . 0.429 ' HE3' ' CE2' ' A' ' 501' ' ' TYR . 42.2 pttt -94.51 -22.83 17.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.262 -0.881 . . . . 71.519999999999996 110.831 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.478 ' O ' ' HB ' ' A' ' 498' ' ' THR . 6.6 m-85 -118.88 133.67 55.68 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.703 -0.48 . . . . 54.119999999999997 109.703 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 502' ' ' ARG . . . . . 0.619 ' HB2' ' CG2' ' A' ' 513' ' ' ILE . 33.7 mmt180 -122.99 126.79 47.83 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.902 -0.407 . . . . 74.439999999999998 109.902 176.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 503' ' ' PHE . . . . . 0.487 ' HE1' HG21 ' A' ' 498' ' ' THR . 88.7 m-85 -94.98 113.26 24.95 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.063 -0.347 . . . . 74.25 110.063 178.636 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.647 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 4.7 mptp? -102.08 119.89 39.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.608 -0.269 . . . . 72.319999999999993 111.047 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -102.62 111.91 24.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.261 -0.644 . . . . 53.43 109.261 173.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 506' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 509' ' ' ARG . 33.1 t70 -136.28 74.6 1.51 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.299 0.571 . . . . 74.25 110.137 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 82.58 -131.71 10.58 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.804 -0.712 . . . . 51.299999999999997 112.055 -178.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.401 ' HB3' ' O ' ' A' ' 477' ' ' VAL . 20.3 mt-30 -79.23 -23.63 43.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.066 0.46 . . . . 52.399999999999999 110.397 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 506' ' ' ASP . 18.4 ptt180 -89.48 143.32 26.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.501 -0.772 . . . . 73.109999999999999 110.805 -177.499 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 -130.26 118.96 22.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.826 -0.624 . . . . 61.020000000000003 109.492 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 511' ' ' HIS . . . . . 0.647 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 13.5 m-70 -101.87 122.84 44.76 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.993 -0.283 . . . . 71.400000000000006 110.349 -176.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 67.8 tp -105.75 108.51 20.06 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.556 -0.535 . . . . 73.540000000000006 109.556 172.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.619 ' CG2' ' HB2' ' A' ' 502' ' ' ARG . 9.8 tp -99.47 124.72 52.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.323 0.582 . . . . 74.109999999999999 110.328 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 74.5 mt -104.29 111.7 34.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 108.93 -0.767 . . . . 72.409999999999997 108.93 173.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -72.92 -44.04 61.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.132 0.491 . . . . 73.230000000000004 110.829 -176.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -131.24 108.85 9.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.815 -0.629 . . . . 75.5 109.885 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.428 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -90.52 131.37 36.3 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.191 -0.459 . . . . 73.219999999999999 110.768 -178.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 518' ' ' MET . . . . . 0.527 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 10.1 mmt -95.69 167.25 11.4 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.225 -0.443 . . . . 74.010000000000005 110.502 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.485 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.7 mm? -62.39 -53.73 50.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.88 0.371 . . . . 74.430000000000007 111.593 -176.203 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -81.57 -12.15 58.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.114 0.483 . . . . 74.349999999999994 110.669 -177.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 521' ' ' ASP . . . . . 0.527 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 29.1 t70 -74.93 -16.41 60.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.713 -0.676 . . . . 74.0 111.057 -175.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.567 ' HB1' ' O ' ' A' ' 538' ' ' LEU . . . -61.42 -41.77 97.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.644 -0.253 . . . . 43.130000000000003 110.409 -178.044 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 40.0 -157.23 0.03 OUTLIER Glycine 0 CA--C 1.522 0.53 0 N-CA-C 116.0 1.16 . . . . 72.5 116.0 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -118.49 107.24 13.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.57 -0.815 . . . . 63.509999999999998 109.056 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 525' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' A' ' 493' ' ' LEU . 29.0 m-85 -85.94 133.55 33.93 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.069 0.461 . . . . 64.329999999999998 111.283 -176.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -135.56 137.75 42.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.769 -0.65 . . . . 72.030000000000001 110.558 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.568 HD11 ' HB ' ' A' ' 484' ' ' VAL . 42.1 tp -102.87 110.09 21.89 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.054 -0.521 . . . . 60.340000000000003 110.172 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 528' ' ' CYS . . . . . 0.416 ' SG ' HD13 ' A' ' 487' ' ' LEU . 94.6 m -90.76 117.09 29.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.147 -0.478 . . . . 62.32 110.189 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.634 HG23 HG12 ' A' ' 484' ' ' VAL . 0.2 OUTLIER -115.82 -169.86 1.67 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.88 -0.6 . . . . 43.229999999999997 110.275 -177.711 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 530' ' ' SER . . . . . 0.55 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 17.3 m -55.57 8.96 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.12 1.368 . . . . 74.219999999999999 113.772 173.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 531' ' ' GLY . . . . . 0.513 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.76 26.88 2.03 Favored Glycine 0 N--CA 1.45 -0.405 0 CA-C-O 121.515 0.508 . . . . 42.210000000000001 111.942 -170.546 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -115.04 144.47 18.45 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 109.608 -1.397 . . . . 61.140000000000001 109.608 165.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -132.7 120.74 22.1 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 117.586 0.693 . . . . 72.439999999999998 111.405 -174.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -127.44 147.1 50.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.658 -0.701 . . . . 74.010000000000005 109.658 173.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.506 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.0 tm? -123.43 137.76 54.74 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.879 -0.415 . . . . 44.109999999999999 109.879 -176.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.542 ' HB2' ' CB ' ' A' ' 460' ' ' LEU . . . -132.51 141.05 48.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.439 -0.346 . . . . 71.409999999999997 110.324 177.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -121.47 117.21 26.28 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.233 0.539 . . . . 63.299999999999997 110.978 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.567 ' O ' ' HB1' ' A' ' 522' ' ' ALA . 46.9 tp -102.01 140.47 36.25 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.284 -0.871 . . . . 73.409999999999997 109.162 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.585 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 5.0 mp -125.28 108.62 20.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.536 -0.542 . . . . 41.509999999999998 109.536 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.453 HG23 ' HB2' ' A' ' 522' ' ' ALA . 66.7 t -107.13 129.3 61.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.921 0.391 . . . . 74.209999999999994 110.647 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -129.51 150.95 50.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.833 -0.622 . . . . 63.119999999999997 109.529 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 542' ' ' GLU . . . . . 0.512 ' HG2' HG21 ' A' ' 467' ' ' VAL . 34.3 mt-10 -73.93 108.75 6.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.059 0.457 . . . . 73.019999999999996 110.407 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 543' ' ' LYS . . . . . 0.405 ' HG3' ' HG2' ' A' ' 466' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 N-CA-C 108.889 -0.782 . . . . 72.450000000000003 108.889 179.097 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo . . . . . 0 N--CA 1.454 -0.816 0 N-CA-C 111.205 -0.344 . . . . 65.219999999999999 111.205 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.455 ' H ' ' HB2' ' A' ' 530' ' ' SER . 94.7 t -76.2 107.69 7.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 109.485 -0.561 . . . . 75.200000000000003 109.485 178.151 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 54.6 tp -98.43 133.42 42.84 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.67 -0.695 . . . . 70.519999999999996 110.142 -176.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 54.2 mt -74.04 102.84 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 109.242 -0.651 . . . . 74.430000000000007 109.242 178.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.25 -13.19 57.42 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.415 -0.812 . . . . 42.530000000000001 110.657 -173.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.478 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 18.8 tpp180 -137.95 112.04 8.82 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 116.001 -0.545 . . . . 63.229999999999997 109.764 175.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -57.19 166.2 4.57 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.786 2.324 . . . . 70.030000000000001 111.669 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.691 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 1.7 mm? -74.3 171.75 13.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.385 -0.371 . . . . 71.340000000000003 110.474 -175.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -66.67 148.25 52.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.868 -0.606 . . . . 73.409999999999997 111.805 -171.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -105.35 9.94 33.63 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.768 1.025 . . . . 73.219999999999999 113.768 -169.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.92 153.18 38.81 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 119.063 -1.055 . . . . 75.349999999999994 112.592 -165.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.575 ' H ' HD23 ' A' ' 464' ' ' LEU . 1.9 pt? -94.18 146.9 23.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.008 -1.451 . . . . 73.409999999999997 111.353 -173.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.617 HG23 HG22 ' A' ' 540' ' ' VAL . 29.7 m -128.34 177.2 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 73.099999999999994 111.682 -175.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -109.31 165.82 11.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 75.049999999999997 110.276 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 467' ' ' VAL . . . . . 0.435 HG12 ' HA ' ' A' ' 518' ' ' MET . 13.9 m -68.08 139.56 20.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.003 0.43 . . . . 62.549999999999997 111.263 177.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 78.61 4.03 87.31 Favored Glycine 0 CA--C 1.518 0.268 0 CA-C-N 115.899 -0.591 . . . . 62.350000000000001 113.452 175.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -108.21 143.85 36.46 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.848 -0.427 . . . . 52.229999999999997 109.848 178.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 470' ' ' ARG . . . . . 0.6 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 0.0 OUTLIER -66.42 140.4 58.05 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.18 0.514 . . . . 62.450000000000003 110.997 -179.134 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.475 HG22 HG21 ' A' ' 465' ' ' VAL . 4.6 t -114.52 133.37 60.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.712 -0.676 . . . . 61.039999999999999 109.654 177.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -112.37 119.47 38.37 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.054 0.454 . . . . 75.040000000000006 110.467 178.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.493 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 36.6 m-85 -109.46 130.58 55.49 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.524 -0.762 . . . . 63.5 110.635 174.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -109.65 140.55 43.35 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.016 -0.538 . . . . 72.0 110.149 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.639 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 21.9 p -149.47 125.46 10.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.788 0.328 . . . . 63.210000000000001 110.872 177.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.478 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 44.8 mt-10 -108.56 140.92 41.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.15 -0.477 . . . . 75.540000000000006 109.739 178.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.434 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 27.9 m -130.24 170.6 18.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.61 0.243 . . . . 75.530000000000001 110.658 176.261 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 12.5 p -70.6 -35.3 72.93 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.514 0.561 . . . . 51.219999999999999 112.514 -174.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 479' ' ' GLU . . . . . 0.572 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 39.6 tt0 -101.96 134.14 45.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.72 0.295 . . . . 72.200000000000003 110.93 -178.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 480' ' ' GLU . . . . . 0.607 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 14.0 pt-20 -79.23 132.26 36.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.954 0.407 . . . . 74.439999999999998 110.059 176.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 481' ' ' GLY . . . . . 0.556 ' HA2' ' HD2' ' A' ' 505' ' ' LYS . . . 75.93 12.01 84.28 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.783 -0.723 . . . . 23.350000000000001 112.437 -176.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.572 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -60.37 141.58 56.09 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.781 0.324 . . . . 74.310000000000002 111.477 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 483' ' ' GLN . . . . . 0.405 ' CD ' ' H ' ' A' ' 483' ' ' GLN . 5.1 pm0 -83.69 118.03 23.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.321 0.581 . . . . 72.230000000000004 110.558 -178.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 26.3 m -136.12 159.69 38.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.656 -0.702 . . . . 75.519999999999996 110.222 -178.074 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 66.0 pttt -136.0 152.94 51.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.806 0.336 . . . . 71.340000000000003 110.497 176.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -102.78 134.0 46.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.094 -0.503 . . . . 72.519999999999996 111.359 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 487' ' ' LEU . . . . . 0.557 HD13 ' SG ' ' A' ' 528' ' ' CYS . 10.7 mp -118.33 136.28 53.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.699 -0.682 . . . . 73.230000000000004 109.205 172.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.463 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 3.0 tmmm? -120.66 110.33 16.28 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.878 0.37 . . . . 72.219999999999999 110.077 -177.448 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.5 t70 58.04 35.66 25.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.182 -0.917 . . . . 74.319999999999993 110.591 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 92.79 -9.23 75.89 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.673 -0.694 . . . . 61.350000000000001 112.88 178.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 46.9 t -101.42 122.95 54.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 110.189 -0.3 . . . . 71.439999999999998 110.189 -179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' GLU . . . . . 0.542 ' HA ' ' HG ' ' A' ' 487' ' ' LEU . 36.0 tt0 -70.99 127.82 33.87 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.097 -0.501 . . . . 65.140000000000001 110.232 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.665 HD11 ' HE1' ' A' ' 525' ' ' TYR . 91.7 mt -77.53 119.82 21.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.269 -0.423 . . . . 74.5 110.24 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 15.0 t -71.64 144.51 49.39 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.184 0.516 . . . . 71.329999999999998 110.234 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 495' ' ' ARG . . . . . 0.496 ' HD3' ' N ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -113.98 10.3 17.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.052 -0.522 . . . . 73.230000000000004 109.983 -179.387 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -79.4 -36.2 39.49 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.112 -0.699 . . . . 54.420000000000002 109.112 175.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.77 133.79 47.2 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.809 -0.812 . . . . 74.329999999999998 108.809 172.131 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.519 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.3 OUTLIER -151.17 88.72 1.47 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.348 0.594 . . . . 62.25 111.164 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -101.92 -23.66 14.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.494 -0.775 . . . . 72.530000000000001 109.289 176.111 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -92.61 -22.63 19.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.505 -0.77 . . . . 55.329999999999998 110.406 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.519 ' O ' ' HB ' ' A' ' 498' ' ' THR . 27.7 m-85 -128.97 161.05 30.81 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.402 -0.363 . . . . 74.030000000000001 110.355 -176.179 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 502' ' ' ARG . . . . . 0.429 ' HD2' ' HA ' ' A' ' 502' ' ' ARG . 2.1 tpt180 -152.94 123.84 7.41 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.171 -0.678 . . . . 72.420000000000002 109.171 173.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -95.03 112.84 24.5 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.191 -0.459 . . . . 64.200000000000003 110.39 -176.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.93 124.48 48.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.973 0.416 . . . . 75.299999999999997 110.635 178.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.556 ' HD2' ' HA2' ' A' ' 481' ' ' GLY . 1.6 tppp? -91.5 126.38 36.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.706 -0.679 . . . . 75.230000000000004 109.577 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -148.12 84.3 1.51 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.327 0.584 . . . . 74.439999999999998 110.573 -176.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.4 -127.22 29.01 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.669 -0.696 . . . . 53.439999999999998 112.699 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 78.1 mt-30 -84.66 -3.65 58.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.562 0.22 . . . . 74.420000000000002 111.46 -178.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -118.09 153.88 33.02 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.493 0.663 . . . . 71.409999999999997 111.176 -177.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 510' ' ' HIS . . . . . 0.639 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 36.3 m-70 -124.88 126.21 45.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.416 -0.811 . . . . 74.019999999999996 109.17 -179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 64.8 m-70 -101.54 117.33 34.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.518 -0.549 . . . . 74.129999999999995 109.518 -177.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 55.4 tp -101.32 121.68 42.32 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.293 -0.412 . . . . 70.030000000000001 110.059 178.105 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 10.8 tp -106.39 130.3 58.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.729 -0.471 . . . . 73.329999999999998 109.729 176.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.6 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 54.6 mt -105.47 112.59 39.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.781 -0.822 . . . . 73.019999999999996 108.781 171.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -75.34 -48.49 22.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.956 -0.566 . . . . 64.420000000000002 110.646 -176.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -122.18 108.41 13.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.87 -0.605 . . . . 71.200000000000003 110.125 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -101.82 136.45 41.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.1 -0.5 . . . . 51.43 111.288 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 518' ' ' MET . . . . . 0.435 ' HA ' HG12 ' A' ' 467' ' ' VAL . 9.3 mmt -126.47 175.97 7.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.951 -0.568 . . . . 75.439999999999998 110.711 175.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.501 HD22 ' H ' ' A' ' 519' ' ' LEU . 2.9 mm? -61.49 -55.66 28.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.38 -0.373 . . . . 75.319999999999993 111.586 -171.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -84.14 -10.15 58.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.821 0.343 . . . . 75.420000000000002 111.376 -177.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -80.15 -13.0 59.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.128 -0.487 . . . . 44.32 109.876 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.601 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -70.73 -41.64 71.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.195 -0.457 . . . . 63.310000000000002 111.021 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.54 -158.25 0.07 OUTLIER Glycine 0 CA--C 1.523 0.583 0 N-CA-C 114.975 0.75 . . . . 63.039999999999999 114.975 176.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -117.22 110.9 18.71 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.271 -0.64 . . . . 72.450000000000003 109.271 174.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 525' ' ' TYR . . . . . 0.665 ' HE1' HD11 ' A' ' 493' ' ' LEU . 30.1 m-85 -85.03 131.72 34.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.489 0.662 . . . . 54.420000000000002 111.756 -174.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.78 126.74 25.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.958 -1.019 . . . . 63.539999999999999 109.699 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 47.4 tp -87.99 115.29 25.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.135 -0.484 . . . . 75.129999999999995 109.971 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 528' ' ' CYS . . . . . 0.557 ' SG ' HD13 ' A' ' 487' ' ' LEU . 76.3 m -94.61 113.08 24.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.133 0.492 . . . . 72.540000000000006 109.864 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.441 ' C ' ' H ' ' A' ' 531' ' ' GLY . 54.6 p -116.85 -166.78 1.2 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.573 -0.74 . . . . 61.530000000000001 111.401 -174.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 530' ' ' SER . . . . . 0.455 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 19.2 m -59.88 6.56 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.792 1.237 . . . . 71.450000000000003 113.234 174.082 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 531' ' ' GLY . . . . . 0.441 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.47 28.22 1.65 Allowed Glycine 0 C--O 1.228 -0.251 0 C-N-CA 120.992 -0.623 . . . . 74.140000000000001 113.677 -176.495 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -116.55 138.14 14.16 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 109.607 -1.397 . . . . 73.209999999999994 109.607 163.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.67 143.31 51.09 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 117.8 0.8 . . . . 73.530000000000001 112.302 -172.271 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -154.59 143.78 21.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.103 -0.953 . . . . 64.519999999999996 109.097 175.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.448 HD13 ' N ' ' A' ' 536' ' ' ALA . 3.2 tm? -127.02 135.73 51.24 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.852 -0.425 . . . . 53.030000000000001 109.852 -176.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.691 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -135.43 159.99 39.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.267 -0.424 . . . . 74.340000000000003 110.561 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -125.56 120.42 30.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.044 -0.526 . . . . 75.409999999999997 110.218 -178.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' A' ' 522' ' ' ALA . 50.3 tp -99.67 126.99 45.78 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.264 -0.643 . . . . 71.409999999999997 109.264 178.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.423 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 66.4 mt -113.79 116.75 53.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 116.372 -0.376 . . . . 71.329999999999998 110.323 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.617 HG22 HG23 ' A' ' 465' ' ' VAL . 95.4 t -109.66 134.34 52.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.496 -0.557 . . . . 74.409999999999997 109.496 175.269 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.05 164.37 18.71 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.022 -0.733 . . . . 62.109999999999999 109.022 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -86.9 105.23 16.93 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.571 -0.529 . . . . 64.400000000000006 109.571 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 53.6 pttt . . . . . 0 C--O 1.247 0.929 0 CA-C-N 115.679 -0.691 . . . . 74.25 109.471 178.241 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo . . . . . 0 N--CA 1.458 -0.598 0 N-CA-C 110.644 -0.56 . . . . 62.439999999999998 110.644 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.575 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 58.8 t -65.95 114.24 3.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.918 0.389 . . . . 73.329999999999998 110.883 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 44.5 tp -89.2 157.77 18.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.686 -0.688 . . . . 50.009999999999998 110.545 -177.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.579 HD13 HD23 ' A' ' 527' ' ' LEU . 37.5 mt -101.96 112.61 35.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.052 -0.522 . . . . 75.129999999999995 110.087 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 20.9 p -86.49 -26.91 24.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.29 -0.414 . . . . 63.539999999999999 111.556 -176.122 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.503 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 7.1 tpt180 -107.1 114.35 61.42 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.277 -0.42 . . . . 74.420000000000002 110.091 177.527 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 459' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 458' ' ' ARG . 37.4 Cg_endo -65.95 158.12 55.78 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 122.589 2.193 . . . . 62.109999999999999 111.446 176.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.625 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 8.8 mp -73.61 160.45 31.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.115 -0.493 . . . . 43.539999999999999 110.574 -178.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 461' ' ' GLU . . . . . 0.479 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 0.2 OUTLIER -65.0 146.99 54.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.512 0.673 . . . . 72.439999999999998 112.216 -173.599 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -104.35 7.36 35.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.933 -1.031 . . . . 71.540000000000006 112.515 -171.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 463' ' ' GLN . . . . . 0.478 HE22 ' HB3' ' A' ' 461' ' ' GLU . 0.2 OUTLIER -124.49 154.13 40.99 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.872 -0.731 . . . . 72.239999999999995 111.805 -167.745 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.695 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.3 pt? -118.44 145.46 45.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.825 -1.079 . . . . 70.010000000000005 111.414 -168.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.443 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 29.3 m -119.77 177.15 3.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 53.130000000000003 111.485 -176.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -107.83 172.03 7.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.919 -0.582 . . . . 74.219999999999999 110.383 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 40.3 t -62.45 130.31 26.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.455 -0.339 . . . . 72.430000000000007 110.995 -178.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 90.54 7.37 67.02 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.776 -0.726 . . . . 62.240000000000002 112.626 178.181 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -117.85 138.73 51.91 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.884 0.373 . . . . 72.239999999999995 110.525 178.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 470' ' ' ARG . . . . . 0.554 ' HB2' HD11 ' A' ' 513' ' ' ILE . 0.0 OUTLIER -82.02 153.6 26.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.697 -0.683 . . . . 65.209999999999994 111.451 -179.124 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.433 HG12 ' HB ' ' A' ' 514' ' ' ILE . 7.4 p -145.42 131.08 13.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.991 -0.549 . . . . 73.019999999999996 110.58 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.437 ' CG ' HD13 ' A' ' 513' ' ' ILE . 41.0 mt-10 -99.37 128.21 45.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.433 -0.349 . . . . 74.299999999999997 110.964 177.121 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.479 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 92.9 m-85 -107.6 112.16 24.75 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.625 -0.88 . . . . 74.040000000000006 108.625 167.57 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -96.45 140.24 31.38 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.232 0.539 . . . . 75.099999999999994 110.623 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.591 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 8.7 p -139.25 137.81 36.24 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.451 -0.795 . . . . 75.310000000000002 109.779 176.431 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.503 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 45.3 mt-10 -119.46 138.98 52.78 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.529 -0.545 . . . . 70.5 109.529 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.575 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 9.6 m -122.58 152.14 26.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 116.106 -0.497 . . . . 74.409999999999997 110.917 -177.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 6.5 m -63.19 -19.63 64.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.818 -0.628 . . . . 61.130000000000003 112.094 -178.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 479' ' ' GLU . . . . . 0.499 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 35.8 tt0 -108.75 135.25 50.28 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.819 0.342 . . . . 75.319999999999993 110.437 -176.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 480' ' ' GLU . . . . . 0.667 ' HA ' ' HG2' ' A' ' 508' ' ' GLN . 13.7 pt-20 -75.49 135.96 40.64 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.177 -0.465 . . . . 71.340000000000003 110.577 -178.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 481' ' ' GLY . . . . . 0.445 ' HA2' ' HD3' ' A' ' 505' ' ' LYS . . . 67.05 8.74 51.26 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.145 -0.55 . . . . 41.109999999999999 113.075 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.527 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -57.67 139.59 53.36 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 120.849 0.356 . . . . 74.230000000000004 111.221 -177.103 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -79.43 128.29 33.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.648 -0.705 . . . . 65.129999999999995 110.143 -177.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.619 ' HB ' HD11 ' A' ' 527' ' ' LEU . 32.7 m -121.88 150.85 25.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.253 -0.431 . . . . 73.150000000000006 110.258 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -134.83 134.98 41.39 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.766 -0.457 . . . . 63.229999999999997 109.766 179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 486' ' ' TRP . . . . . 0.431 ' CD2' HD22 ' A' ' 512' ' ' LEU . 72.0 m95 -103.34 131.46 50.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.919 0.39 . . . . 75.519999999999996 111.165 -175.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 487' ' ' LEU . . . . . 0.567 ' HG ' ' HA ' ' A' ' 492' ' ' GLU . 10.7 mp -120.02 158.02 27.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.903 -0.589 . . . . 72.140000000000001 109.47 174.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.468 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 1.7 tmmm? -140.81 109.27 5.88 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.116 -0.327 . . . . 75.450000000000003 110.116 -178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 57.63 35.4 25.64 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.898 -0.592 . . . . 74.420000000000002 111.061 -177.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 86.94 -11.78 63.76 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.778 -0.646 . . . . 72.239999999999995 112.741 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 60.7 t -79.03 122.95 35.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.805 -0.443 . . . . 44.32 109.805 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 492' ' ' GLU . . . . . 0.567 ' HA ' ' HG ' ' A' ' 487' ' ' LEU . 33.4 tt0 -78.71 111.31 14.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.902 -0.59 . . . . 72.25 110.2 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 86.9 mt -68.37 134.94 51.03 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.016 0.436 . . . . 61.030000000000001 110.177 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 14.3 t -91.58 160.16 15.54 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.978 -0.555 . . . . 71.219999999999999 110.024 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 -125.82 11.94 7.84 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.813 -0.63 . . . . 74.310000000000002 110.559 -177.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -75.55 -35.06 60.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.613 -0.721 . . . . 53.539999999999999 109.801 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -136.23 139.6 42.86 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.621 -0.881 . . . . 73.310000000000002 108.621 170.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.562 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.6 OUTLIER -150.37 88.01 1.48 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.434 0.635 . . . . 63.509999999999998 111.166 179.094 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -104.94 -17.97 14.35 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.591 -0.732 . . . . 52.240000000000002 109.912 174.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -92.72 -47.05 7.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.733 -0.667 . . . . 65.409999999999997 109.841 174.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.562 ' O ' ' HB ' ' A' ' 498' ' ' THR . 45.6 m-85 -103.17 161.21 13.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.928 -0.578 . . . . 70.129999999999995 109.926 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 502' ' ' ARG . . . . . 0.472 ' HB2' HG23 ' A' ' 513' ' ' ILE . 49.1 mtp180 -144.34 135.49 25.35 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.175 -0.676 . . . . 61.399999999999999 109.175 174.09 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -107.4 113.14 26.31 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.475 -0.565 . . . . 73.230000000000004 109.475 -175.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -120.4 145.83 46.8 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.858 -0.61 . . . . 62.210000000000001 110.968 -172.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.445 ' HD3' ' HA2' ' A' ' 481' ' ' GLY . 3.7 ttmp? -128.82 118.42 22.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.847 -0.615 . . . . 73.140000000000001 109.846 -178.121 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 506' ' ' ASP . . . . . 0.54 ' HB3' ' HG3' ' A' ' 509' ' ' ARG . 15.3 t70 -127.62 82.73 2.1 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.421 -0.585 . . . . 73.310000000000002 109.421 177.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.37 -101.18 0.59 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.059 -0.591 . . . . 75.420000000000002 112.041 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.667 ' HG2' ' HA ' ' A' ' 480' ' ' GLU . 20.9 mt-30 -109.19 -8.63 15.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.824 0.345 . . . . 73.420000000000002 110.822 -179.394 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.54 ' HG3' ' HB3' ' A' ' 506' ' ' ASP . 36.7 ptt180 -104.94 133.25 50.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.363 0.601 . . . . 60.100000000000001 110.761 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 510' ' ' HIS . . . . . 0.591 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 83.2 m-70 -113.65 144.62 42.61 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.818 -0.628 . . . . 73.420000000000002 109.792 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -119.8 118.32 30.51 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 110.134 -0.321 . . . . 71.010000000000005 110.134 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.431 HD22 ' CD2' ' A' ' 486' ' ' TRP . 53.2 tp -96.55 103.5 15.42 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.597 -0.89 . . . . 64.200000000000003 108.597 170.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.554 HD11 ' HB2' ' A' ' 470' ' ' ARG . 5.4 tp -101.34 112.63 34.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 121.482 0.658 . . . . 61.520000000000003 110.505 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.519 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 60.9 mt -86.46 115.53 27.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 108.482 -0.933 . . . . 64.200000000000003 108.482 174.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -68.82 -51.52 39.84 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.961 0.41 . . . . 72.340000000000003 110.537 -177.039 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -133.76 109.41 9.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.802 -0.636 . . . . 74.530000000000001 109.841 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -88.0 138.43 31.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.974 0.416 . . . . 71.409999999999997 111.017 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 518' ' ' MET . . . . . 0.648 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 25.4 mmt -109.34 170.12 8.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.923 -0.58 . . . . 62.119999999999997 110.371 179.087 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.556 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.0 mm? -64.24 -53.52 47.78 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.241 -0.436 . . . . 72.129999999999995 111.229 -173.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -81.38 -5.06 57.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.262 -0.426 . . . . 75.430000000000007 110.907 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 521' ' ' ASP . . . . . 0.648 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 7.9 t70 -86.8 -14.56 41.87 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.088 -0.505 . . . . 74.019999999999996 110.57 -176.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.673 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -69.16 -43.67 73.81 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.817 -0.353 . . . . 75.510000000000005 111.344 -175.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 523' ' ' GLY . . . . . 0.468 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 40.27 -158.53 0.02 OUTLIER Glycine 0 CA--C 1.524 0.655 0 N-CA-C 115.9 1.12 . . . . 74.409999999999997 115.9 172.269 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -111.14 111.55 22.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.78 -0.71 . . . . 73.129999999999995 109.086 170.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 525' ' ' TYR . . . . . 0.454 ' HH ' ' HE1' ' A' ' 501' ' ' TYR . 40.4 m-85 -86.19 131.53 34.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.028 0.442 . . . . 71.239999999999995 111.103 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -132.27 126.09 32.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.589 -0.732 . . . . 72.209999999999994 110.073 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.619 HD11 ' HB ' ' A' ' 484' ' ' VAL . 45.5 tp -86.9 119.92 27.63 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.196 -0.456 . . . . 73.230000000000004 110.12 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 528' ' ' CYS . . . . . 0.504 ' SG ' HD13 ' A' ' 487' ' ' LEU . 86.4 m -100.88 112.97 25.51 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.457 -0.571 . . . . 61.32 109.457 177.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.533 HG23 HG12 ' A' ' 484' ' ' VAL . 0.2 OUTLIER -115.89 -168.39 1.41 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.642 -0.708 . . . . 40.0 110.389 -175.946 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 530' ' ' SER . . . . . 0.447 ' H ' HG22 ' A' ' 529' ' ' THR . 7.5 m -55.21 7.25 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.935 1.294 . . . . 22.420000000000002 113.694 173.621 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 531' ' ' GLY . . . . . 0.524 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.9 26.83 2.01 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-O 121.638 0.577 . . . . 72.430000000000007 111.831 -168.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -114.91 150.23 18.74 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 109.684 -1.366 . . . . 52.409999999999997 109.684 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.77 142.75 46.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 117.55 0.675 . . . . 72.030000000000001 110.762 -176.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -153.06 123.48 7.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.656 -0.702 . . . . 72.439999999999998 109.778 177.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.438 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.7 tm? -103.99 132.82 49.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.173 -0.467 . . . . 74.510000000000005 110.114 -177.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.625 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -121.02 149.25 42.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.37 -0.377 . . . . 53.109999999999999 110.42 177.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -116.31 120.58 39.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.173 -0.467 . . . . 62.119999999999997 110.084 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 522' ' ' ALA . 48.3 tp -127.51 134.73 49.78 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.284 -0.416 . . . . 71.420000000000002 110.462 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.579 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.8 mp -130.8 125.23 58.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.128 -0.693 . . . . 64.129999999999995 109.128 174.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.673 HG23 ' HB2' ' A' ' 522' ' ' ALA . 70.1 t -104.41 143.71 15.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 110.02 -0.363 . . . . 63.32 110.02 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 18.0 mp0 -126.29 150.26 48.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.756 0.312 . . . . 63.299999999999997 110.628 -176.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 542' ' ' GLU . . . . . 0.556 ' HG3' HD11 ' A' ' 519' ' ' LEU . 45.2 mt-10 -89.5 123.33 33.51 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.698 -0.683 . . . . 55.25 110.185 175.611 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 543' ' ' LYS . . . . . 0.509 ' C ' ' HD2' ' A' ' 543' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.89 0 CA-C-N 115.6 -0.727 . . . . 72.439999999999998 109.809 177.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo . . . . . 0 N--CA 1.462 -0.367 0 CA-C-O 120.723 0.218 . . . . 42.219999999999999 111.662 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.495 ' H ' ' HB2' ' A' ' 530' ' ' SER . 87.2 t -64.51 108.79 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.215 0.531 . . . . 64.420000000000002 110.408 178.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 50.1 tp -80.63 139.29 36.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.595 -0.73 . . . . 73.540000000000006 110.17 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 55.1 mt -91.14 114.93 29.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.867 -0.606 . . . . 72.319999999999993 109.789 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 24.7 p -86.2 -17.96 33.44 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.264 0.554 . . . . 75.329999999999998 111.498 -175.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.42 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 10.9 tpt85 -136.95 104.64 8.87 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.955 -0.566 . . . . 73.450000000000003 110.359 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 459' ' ' PRO . . . . . 0.41 ' HA ' ' HB1' ' A' ' 534' ' ' ALA . 26.2 Cg_exo -62.71 167.38 11.87 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.891 2.394 . . . . 54.32 111.285 174.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.689 ' HB2' ' CB ' ' A' ' 536' ' ' ALA . 0.8 OUTLIER -69.81 167.84 16.37 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.606 -0.516 . . . . 63.530000000000001 109.606 -177.79 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 461' ' ' GLU . . . . . 0.531 ' OE1' ' HA ' ' A' ' 461' ' ' GLU . 2.4 tp10 -73.15 161.59 30.42 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.264 0.554 . . . . 74.340000000000003 111.64 -172.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -104.25 8.76 36.16 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.989 1.107 . . . . 74.519999999999996 113.989 -166.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.11 154.23 37.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.381 0.991 . . . . 54.229999999999997 112.471 -165.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.686 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.5 pt? -106.56 146.83 30.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.051 -1.431 . . . . 74.299999999999997 111.576 -170.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.466 HG22 HD11 ' A' ' 538' ' ' LEU . 30.1 m -123.36 177.41 4.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.006 0.431 . . . . 65.319999999999993 111.457 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -97.5 166.75 11.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.008 -0.542 . . . . 74.230000000000004 110.986 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 467' ' ' VAL . . . . . 0.409 HG22 HG12 ' A' ' 540' ' ' VAL . 38.3 t -62.08 127.35 21.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.716 -0.675 . . . . 33.25 111.604 -176.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 88.16 -13.35 61.82 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.003 -0.617 . . . . 72.040000000000006 113.144 174.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -87.58 144.58 26.62 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.95 -0.389 . . . . 61.009999999999998 109.95 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 470' ' ' ARG . . . . . 0.627 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 2.3 ppt_? -76.65 145.56 38.74 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.276 0.56 . . . . 65.219999999999999 111.234 -177.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.445 HG12 ' HB ' ' A' ' 514' ' ' ILE . 7.2 p -131.9 142.26 43.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.674 -0.694 . . . . 72.430000000000007 109.978 178.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.562 ' HG2' HD13 ' A' ' 513' ' ' ILE . 34.1 mt-10 -112.19 125.3 53.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 75.540000000000006 110.546 -176.217 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.525 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 59.6 m-85 -112.88 123.2 49.77 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.287 -0.415 . . . . 65.109999999999999 111.34 178.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -95.02 138.33 32.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.736 -0.666 . . . . 63.420000000000002 110.543 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.644 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 6.0 p -148.81 133.3 17.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.25 -0.432 . . . . 53.399999999999999 110.387 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.48 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 43.9 mt-10 -131.78 139.81 49.02 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.36 -0.237 . . . . 64.409999999999997 110.36 -178.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 30.1 m -123.41 161.15 25.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.343 -0.39 . . . . 72.120000000000005 110.488 177.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 34.3 t -80.9 8.47 8.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.271 -0.422 . . . . 53.520000000000003 112.114 -175.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 479' ' ' GLU . . . . . 0.546 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 4.5 tp10 -128.85 141.27 51.35 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.029 -0.359 . . . . 70.400000000000006 110.029 -179.194 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 480' ' ' GLU . . . . . 0.51 ' HA ' ' HG2' ' A' ' 508' ' ' GLN . 1.0 OUTLIER -88.84 136.92 32.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.746 0.308 . . . . 74.409999999999997 110.426 -178.954 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 60.55 31.75 75.79 Favored Glycine 0 C--N 1.33 0.217 0 C-N-CA 120.706 -0.759 . . . . 71.129999999999995 111.783 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.546 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -74.46 146.27 42.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.951 0.405 . . . . 63.25 111.303 -175.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 483' ' ' GLN . . . . . 0.527 ' CD ' ' H ' ' A' ' 483' ' ' GLN . 4.0 pm0 -78.2 111.33 14.02 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.764 -0.653 . . . . 63.140000000000001 110.326 179.318 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.68 HG12 HG22 ' A' ' 529' ' ' THR . 17.3 m -131.86 151.21 34.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.666 -0.697 . . . . 71.400000000000006 110.245 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -135.06 155.13 51.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.902 0.382 . . . . 75.040000000000006 110.196 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 486' ' ' TRP . . . . . 0.584 ' HB3' HD12 ' A' ' 493' ' ' LEU . 52.2 m95 -105.57 127.24 52.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.132 -0.486 . . . . 63.539999999999999 110.908 -179.07 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 487' ' ' LEU . . . . . 0.554 HD12 ' SG ' ' A' ' 528' ' ' CYS . 65.1 mt -123.96 136.59 54.41 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.847 -0.615 . . . . 73.010000000000005 109.415 175.374 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.501 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 3.3 tmmm? -120.65 106.47 11.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.303 -0.408 . . . . 71.230000000000004 110.215 -177.54 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 489' ' ' ASP . . . . . 0.54 ' HB2' ' H ' ' A' ' 524' ' ' HIS . 13.7 t70 57.14 35.55 26.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.541 -0.754 . . . . 72.049999999999997 110.86 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 88.43 -3.72 85.28 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.794 -0.639 . . . . 62.240000000000002 112.513 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 89.5 t -94.69 128.2 46.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.722 0.296 . . . . 71.109999999999999 110.818 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 492' ' ' GLU . . . . . 0.524 ' HA ' ' CD2' ' A' ' 487' ' ' LEU . 4.7 tp10 -70.01 126.96 31.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.847 -0.615 . . . . 73.510000000000005 110.432 178.039 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.584 HD12 ' HB3' ' A' ' 486' ' ' TRP . 75.8 mt -87.55 98.01 11.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.119 0.485 . . . . 60.340000000000003 109.753 175.447 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 494' ' ' THR . . . . . 0.504 ' OG1' ' HG2' ' A' ' 496' ' ' GLU . 6.2 t -64.27 123.33 18.84 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.599 -0.728 . . . . 72.040000000000006 111.223 -176.439 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 495' ' ' ARG . . . . . 0.636 ' H ' ' NE ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -100.61 13.07 35.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.042 -0.526 . . . . 62.340000000000003 110.768 -179.264 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 496' ' ' GLU . . . . . 0.504 ' HG2' ' OG1' ' A' ' 494' ' ' THR . 10.1 mm-40 -69.22 -36.66 77.48 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.325 -0.62 . . . . 74.319999999999993 109.325 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -151.53 108.22 3.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.143 -0.935 . . . . 71.510000000000005 109.364 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.6 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 21.3 p -114.42 97.8 6.53 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.154 -0.475 . . . . 73.450000000000003 111.547 -176.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -91.03 -28.95 17.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.9 -0.591 . . . . 74.120000000000005 110.192 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -88.76 -46.97 8.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.941 -0.572 . . . . 75.450000000000003 110.312 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.6 ' O ' ' HB ' ' A' ' 498' ' ' THR . 26.2 m-85 -99.32 154.96 17.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.624 -0.716 . . . . 65.040000000000006 110.093 -176.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 502' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 501' ' ' TYR . 21.5 mtp85 -148.09 123.17 10.12 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.549 -0.537 . . . . 75.530000000000001 109.549 171.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 503' ' ' PHE . . . . . 0.464 ' HE2' HG21 ' A' ' 498' ' ' THR . 72.6 m-85 -96.06 118.37 32.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.02 -0.537 . . . . 72.319999999999993 111.465 -172.042 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 4.6 mptp? -105.85 146.0 30.49 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.239 -0.437 . . . . 62.210000000000001 110.054 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -129.37 128.06 42.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.85 0.357 . . . . 71.549999999999997 111.149 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -119.05 79.03 1.34 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.657 -0.701 . . . . 75.129999999999995 109.512 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.49 -90.78 0.24 Allowed Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.838 -0.619 . . . . 53.130000000000003 112.807 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.51 ' HG2' ' HA ' ' A' ' 480' ' ' GLU . 22.7 mt-30 -99.14 -26.06 14.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.804 0.335 . . . . 61.100000000000001 111.019 -177.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.48 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 17.1 ptt180 -103.55 153.74 20.24 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.21 0.529 . . . . 72.030000000000001 111.485 -173.392 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 510' ' ' HIS . . . . . 0.644 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 74.9 m80 -124.64 156.54 37.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.045 -0.525 . . . . 74.109999999999999 110.76 -179.249 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 511' ' ' HIS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 42.0 m-70 -125.99 119.3 27.34 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.08 -0.711 . . . . 75.140000000000001 109.08 176.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.525 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 64.4 tp -98.3 105.68 17.86 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.447 -0.575 . . . . 75.239999999999995 109.447 174.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.562 HD13 ' HG2' ' A' ' 472' ' ' GLU . 8.5 tp -97.54 112.81 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 CA-C-O 121.502 0.668 . . . . 44.420000000000002 109.571 176.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.627 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 45.1 mt -96.66 112.08 28.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.611 -0.885 . . . . 61.030000000000001 108.611 175.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -68.81 -45.01 72.32 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.445 0.466 . . . . 74.030000000000001 111.353 -173.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -134.32 109.59 8.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.198 -0.456 . . . . 42.43 110.185 178.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.542 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -88.27 123.07 32.51 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.097 -0.501 . . . . 52.450000000000003 110.344 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 518' ' ' MET . . . . . 0.724 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 30.2 mmt -90.05 173.36 8.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.256 -0.429 . . . . 75.120000000000005 110.103 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.32 -54.03 50.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.949 0.404 . . . . 75.099999999999994 110.853 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -82.89 -4.48 58.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.752 -0.658 . . . . 53.25 111.103 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 521' ' ' ASP . . . . . 0.724 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 6.8 t70 -80.41 -19.78 45.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.305 -176.308 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.527 ' HA ' HD23 ' A' ' 538' ' ' LEU . . . -62.66 -41.93 99.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.147 -0.479 . . . . 64.200000000000003 111.268 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.19 -157.32 0.07 OUTLIER Glycine 0 C--N 1.335 0.513 0 O-C-N 123.924 0.765 . . . . 65.200000000000003 114.811 173.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 524' ' ' HIS . . . . . 0.54 ' H ' ' HB2' ' A' ' 489' ' ' ASP . 60.5 m80 -120.66 108.65 14.27 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.734 -0.839 . . . . 74.25 108.734 171.242 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 525' ' ' TYR . . . . . 0.501 ' CZ ' ' HG3' ' A' ' 488' ' ' LYS . 26.3 m-85 -85.46 132.04 34.28 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.472 0.654 . . . . 74.200000000000003 111.857 -173.146 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -141.29 131.86 25.46 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.113 -0.949 . . . . 44.020000000000003 109.818 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.49 HD22 ' HB2' ' A' ' 475' ' ' CYS . 61.2 tp -86.67 116.3 24.69 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.245 -0.65 . . . . 71.439999999999998 109.245 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 528' ' ' CYS . . . . . 0.554 ' SG ' HD12 ' A' ' 487' ' ' LEU . 64.6 m -99.73 116.31 31.52 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.424 0.63 . . . . 63.219999999999999 110.597 -176.146 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.68 HG22 HG12 ' A' ' 484' ' ' VAL . 68.0 p -115.64 -165.67 1.06 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.95 -1.023 . . . . 71.430000000000007 110.229 -177.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 530' ' ' SER . . . . . 0.495 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 2.7 m -52.68 4.25 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.645 1.178 . . . . 70.040000000000006 113.274 172.641 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 531' ' ' GLY . . . . . 0.522 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.85 27.59 1.87 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.392 -0.432 . . . . 72.109999999999999 113.233 -175.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -107.95 136.22 13.32 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 109.797 -1.321 . . . . 54.219999999999999 109.797 164.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -113.03 121.06 43.48 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 117.201 0.5 . . . . 72.430000000000007 112.224 -171.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 534' ' ' ALA . . . . . 0.41 ' HB1' ' HA ' ' A' ' 459' ' ' PRO . . . -121.26 140.21 52.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.933 -0.576 . . . . 74.010000000000005 109.474 171.123 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.492 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.8 tm? -128.36 138.94 52.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.767 0.318 . . . . 72.439999999999998 110.48 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.689 ' CB ' ' HB2' ' A' ' 460' ' ' LEU . . . -146.94 159.92 42.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 74.530000000000001 110.112 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -127.04 116.75 21.21 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.057 0.456 . . . . 73.120000000000005 111.057 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.527 HD23 ' HA ' ' A' ' 522' ' ' ALA . 52.6 tp -101.22 133.08 46.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.038 -0.727 . . . . 74.420000000000002 109.038 175.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.68 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 35.5 mt -125.49 116.7 47.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 109.762 -0.459 . . . . 74.219999999999999 109.762 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.542 HG21 ' HB1' ' A' ' 517' ' ' ALA . 97.8 t -112.81 120.16 62.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 120.771 0.319 . . . . 54.539999999999999 110.513 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -131.58 162.21 30.86 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.943 -0.571 . . . . 55.520000000000003 109.798 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -85.33 109.12 18.16 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.44 -0.578 . . . . 61.310000000000002 109.44 173.24 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 543' ' ' LYS . . . . . 0.838 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 10.7 mmpt? . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.426 -0.797 . . . . 71.310000000000002 109.701 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo . . . . . 0 N--CA 1.459 -0.501 0 N-CA-C 111.287 -0.313 . . . . 74.120000000000005 111.287 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.435 ' H ' ' HB2' ' A' ' 530' ' ' SER . 99.2 t -64.93 107.67 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-O 121.199 0.523 . . . . 54.329999999999998 110.063 176.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 47.3 tp -93.63 152.54 18.93 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.512 -0.767 . . . . 72.409999999999997 109.562 -177.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 56.6 mt -105.71 112.9 41.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.205 -0.452 . . . . 74.420000000000002 110.234 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 43.8 p -86.43 -33.91 20.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.181 0.515 . . . . 70.230000000000004 110.416 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.485 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 14.3 tpt180 -114.77 103.91 54.54 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.541 -0.754 . . . . 75.540000000000006 109.26 174.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.2 167.57 19.86 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.968 2.445 . . . . 65.439999999999998 112.272 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.878 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 79.6 mt -66.11 155.24 37.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.032 -0.531 . . . . 74.099999999999994 110.078 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -88.35 162.68 16.42 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.302 0.853 . . . . 73.310000000000002 113.302 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -104.53 6.33 34.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.245 -1.343 . . . . 72.540000000000006 113.93 -161.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -123.86 149.31 45.94 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 118.923 -1.111 . . . . 62.420000000000002 112.753 -162.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.612 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 0.6 OUTLIER -114.48 144.9 42.6 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.97 -1.468 . . . . 71.400000000000006 111.391 -170.523 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 28.2 m -117.92 177.93 2.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.115 -0.493 . . . . 63.219999999999999 111.303 -177.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -103.14 168.07 9.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.012 -0.54 . . . . 71.329999999999998 110.382 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 45.0 t -62.21 130.33 26.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.472 -0.331 . . . . 72.239999999999995 110.829 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 92.46 -11.22 72.61 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.877 -0.678 . . . . 45.210000000000001 112.616 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -101.09 144.17 30.32 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.431 -0.581 . . . . 73.420000000000002 109.431 178.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 470' ' ' ARG . . . . . 0.494 ' C ' ' HD2' ' A' ' 470' ' ' ARG . 0.0 OUTLIER -86.01 150.61 24.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.965 0.412 . . . . 64.129999999999995 110.72 -176.13 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.413 HG12 ' HB ' ' A' ' 514' ' ' ILE . 8.0 p -128.94 137.59 56.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.445 -0.576 . . . . 55.329999999999998 109.445 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.852 ' HG2' HG13 ' A' ' 513' ' ' ILE . 42.6 mt-10 -116.61 124.28 49.41 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.489 -0.323 . . . . 73.25 110.159 -176.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.456 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 76.9 m-85 -107.97 113.27 26.33 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.116 -0.493 . . . . 65.209999999999994 110.286 176.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -95.61 132.36 40.84 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.657 -0.701 . . . . 74.349999999999994 110.295 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.4 t -148.26 121.02 8.66 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.095 0.474 . . . . 53.43 110.507 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.902 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 46.5 mt-10 -112.63 138.72 49.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.799 -0.637 . . . . 73.319999999999993 110.058 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.508 HG21 ' HB3' ' A' ' 482' ' ' ALA . 21.6 m -121.93 178.44 2.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.383 -0.371 . . . . 65.409999999999997 110.781 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 25.0 p -78.22 -21.61 49.73 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.598 0.592 . . . . 50.100000000000001 112.598 -174.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 479' ' ' GLU . . . . . 0.674 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 35.9 tt0 -119.02 138.91 52.5 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.997 0.427 . . . . 73.209999999999994 110.991 -175.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 480' ' ' GLU . . . . . 0.426 ' H ' ' CD ' ' A' ' 480' ' ' GLU . 1.4 pm0 -74.41 126.96 31.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.955 -0.566 . . . . 43.399999999999999 110.368 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 64.35 26.84 70.93 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.616 -0.802 . . . . 52.329999999999998 111.953 -174.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.674 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -57.94 156.76 8.65 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.012 0.745 . . . . 62.329999999999998 113.012 -176.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -71.86 105.48 3.82 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.886 -1.052 . . . . 64.239999999999995 109.553 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.54 ' HB ' HD11 ' A' ' 527' ' ' LEU . 29.3 m -128.06 150.7 34.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.908 0.385 . . . . 73.099999999999994 110.412 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 49.4 tttp -130.29 126.8 38.13 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.206 -0.664 . . . . 63.140000000000001 109.206 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 486' ' ' TRP . . . . . 0.412 ' HB3' HD12 ' A' ' 493' ' ' LEU . 86.1 m95 -100.92 116.81 33.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.739 0.304 . . . . 73.439999999999998 110.885 -175.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 487' ' ' LEU . . . . . 0.415 HD13 ' SG ' ' A' ' 528' ' ' CYS . 7.7 mp -118.23 140.8 49.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.035 -0.529 . . . . 61.229999999999997 110.393 177.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.537 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 4.2 tmmm? -127.22 107.45 10.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.142 -0.688 . . . . 50.25 109.142 176.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 4.7 t70 58.56 35.55 24.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.577 0.703 . . . . 73.120000000000005 110.353 -178.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 92.99 -15.58 62.5 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.824 -0.703 . . . . 70.540000000000006 113.281 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 55.9 t -97.85 123.99 50.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.81 0.305 . . . . 72.430000000000007 110.561 -178.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -70.44 142.6 51.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.932 0.396 . . . . 74.040000000000006 110.75 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.708 HD11 ' HE2' ' A' ' 525' ' ' TYR . 59.7 mt -84.71 118.39 24.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.901 -0.59 . . . . 75.409999999999997 110.197 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 10.6 t -70.46 143.14 51.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.06 0.457 . . . . 72.209999999999994 110.414 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.93 7.64 11.52 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.177 -0.465 . . . . 74.439999999999998 110.596 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -62.18 -50.38 72.06 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.517 0.675 . . . . 75.019999999999996 109.579 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -152.65 118.16 5.3 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.81 -1.086 . . . . 75.519999999999996 108.82 174.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.61 121.65 16.76 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.85 0.357 . . . . 73.439999999999998 110.597 -176.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -107.49 -22.9 12.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.272 -0.422 . . . . 64.340000000000003 111.51 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 500' ' ' LYS . . . . . 0.411 ' HE3' ' CE2' ' A' ' 501' ' ' TYR . 52.3 mtmt -73.97 -46.74 42.01 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.422 -0.585 . . . . 64.230000000000004 109.422 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.728 ' HB3' HG12 ' A' ' 514' ' ' ILE . 0.6 OUTLIER -136.09 144.98 45.45 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.282 -0.872 . . . . 73.510000000000005 110.298 179.032 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.88 140.32 51.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.068 0.461 . . . . 74.120000000000005 110.922 178.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -95.64 120.55 36.09 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.242 -0.89 . . . . 64.209999999999994 109.789 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 0.7 OUTLIER -113.54 121.31 43.83 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.072 0.463 . . . . 74.439999999999998 110.964 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -107.51 113.51 26.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.588 -0.733 . . . . 73.310000000000002 110.476 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.53 101.4 3.98 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.426 0.631 . . . . 74.0 110.581 174.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 80.06 -131.14 10.3 Favored Glycine 0 N--CA 1.444 -0.83 0 CA-C-N 115.456 -0.793 . . . . 52.240000000000002 111.895 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.451 ' HB3' ' O ' ' A' ' 477' ' ' VAL . 26.0 mt-30 -93.47 -10.63 34.34 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.817 0.341 . . . . 61.520000000000003 110.567 -178.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.902 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 25.5 ptt180 -93.52 143.83 25.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.546 0.688 . . . . 71.099999999999994 111.508 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 -124.5 117.71 24.98 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.441 -0.948 . . . . 73.329999999999998 108.441 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 511' ' ' HIS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 13.3 m-70 -101.84 127.57 48.59 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.677 -0.238 . . . . 73.310000000000002 110.739 -172.524 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.456 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 63.0 tp -112.7 103.55 11.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.596 -0.52 . . . . 73.439999999999998 109.596 173.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.852 HG13 ' HG2' ' A' ' 472' ' ' GLU . 1.7 mp -105.08 116.28 48.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.1 -0.5 . . . . 60.43 110.329 179.248 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.728 HG12 ' HB3' ' A' ' 501' ' ' TYR . 53.7 mt -97.81 112.78 30.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.075 -0.713 . . . . 73.5 109.075 175.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -71.19 -44.25 65.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.091 -0.504 . . . . 72.319999999999993 110.542 -175.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -129.86 109.14 10.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.911 -0.586 . . . . 64.109999999999999 109.758 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -89.98 132.16 35.5 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.062 -0.517 . . . . 70.209999999999994 110.335 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 26.1 mmt -112.06 166.51 11.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.076 -0.511 . . . . 71.329999999999998 110.554 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.516 HD22 ' H ' ' A' ' 519' ' ' LEU . 2.9 mm? -58.18 -53.92 52.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 71.209999999999994 111.077 -174.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -82.6 -10.78 58.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.075 -0.511 . . . . 74.420000000000002 111.651 -176.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -85.9 -14.03 46.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.44 -0.346 . . . . 73.439999999999998 110.466 -177.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.644 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -62.72 -41.98 99.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.313 -0.403 . . . . 61.350000000000001 111.361 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.68 -158.13 0.08 OUTLIER Glycine 0 C--N 1.337 0.589 0 O-C-N 123.835 0.709 . . . . 60.509999999999998 114.472 176.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -126.97 112.38 15.2 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.605 -0.887 . . . . 74.019999999999996 108.605 172.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 525' ' ' TYR . . . . . 0.708 ' HE2' HD11 ' A' ' 493' ' ' LEU . 51.7 m-85 -85.74 131.97 34.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.238 0.542 . . . . 75.209999999999994 111.494 -172.363 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -137.55 120.07 16.02 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.553 -0.749 . . . . 64.400000000000006 110.035 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.54 HD11 ' HB ' ' A' ' 484' ' ' VAL . 45.2 tp -87.6 123.35 32.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.152 -0.476 . . . . 64.310000000000002 109.775 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 528' ' ' CYS . . . . . 0.415 ' SG ' HD13 ' A' ' 487' ' ' LEU . 64.6 m -108.68 112.73 25.19 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.054 0.454 . . . . 64.310000000000002 110.202 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.55 ' C ' ' H ' ' A' ' 531' ' ' GLY . 55.1 p -114.61 -165.2 0.99 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.085 -0.507 . . . . 72.530000000000001 109.716 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 530' ' ' SER . . . . . 0.435 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 2.1 m -49.79 4.53 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.087 1.143 . . . . 71.239999999999995 114.087 173.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 531' ' ' GLY . . . . . 0.55 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.55 26.84 2.08 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 121.446 0.47 . . . . 74.120000000000005 112.789 -173.192 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -109.04 138.02 14.52 Favored Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 109.21 -1.556 . . . . 73.209999999999994 109.21 164.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.74 126.14 46.91 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 117.31 0.555 . . . . 64.299999999999997 111.201 -171.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 534' ' ' ALA . . . . . 0.413 ' HB1' ' H ' ' A' ' 460' ' ' LEU . . . -131.89 133.88 45.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.79 -0.641 . . . . 62.32 109.636 174.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.482 HD13 ' N ' ' A' ' 536' ' ' ALA . 1.4 tm? -116.81 133.69 55.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.933 -0.395 . . . . 72.129999999999995 109.933 -177.146 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.878 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -122.09 131.22 53.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.431 -0.35 . . . . 44.450000000000003 110.801 178.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -102.41 116.41 32.56 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.112 -0.494 . . . . 72.329999999999998 110.149 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.506 HD23 ' HA ' ' A' ' 522' ' ' ALA . 33.6 tp -124.11 118.75 27.63 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.266 -0.425 . . . . 72.099999999999994 110.088 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.612 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.2 mp -124.21 109.68 23.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 109.065 -0.717 . . . . 73.040000000000006 109.065 176.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.644 HG23 ' HB2' ' A' ' 522' ' ' ALA . 73.0 t -89.88 129.16 41.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.118 0.485 . . . . 75.510000000000005 110.249 -177.587 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -116.04 168.4 10.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.46 -0.791 . . . . 54.439999999999998 110.222 -174.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 542' ' ' GLU . . . . . 0.42 ' HG3' HD11 ' A' ' 519' ' ' LEU . 47.6 mt-10 -115.03 108.68 17.0 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.524 -0.307 . . . . 61.130000000000003 110.563 174.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 50.1 pttt . . . . . 0 C--O 1.247 0.93 0 CA-C-N 115.569 -0.742 . . . . 75.040000000000006 110.093 177.125 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.81 0 N-CA-C 111.639 -0.584 . . . . 71.400000000000006 111.639 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 10.7 m -84.2 96.72 9.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.959 0.409 . . . . 73.030000000000001 110.162 178.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 15.2 p80 -130.34 11.95 5.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.218 -0.446 . . . . 74.230000000000004 110.452 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 25.2 ptm -75.87 125.14 88.6 Favored Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 109.549 -0.537 . . . . 75.129999999999995 109.549 175.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.75 133.43 12.71 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.046 1.831 . . . . 73.439999999999998 112.267 -177.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.53 ' HB ' ' HB2' ' A' ' 530' ' ' SER . 65.6 t -65.94 108.78 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.295 -0.631 . . . . 73.430000000000007 109.295 172.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 54.7 tp -95.15 137.29 34.4 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.426 -0.807 . . . . 70.019999999999996 110.269 -175.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 58.1 mt -80.29 101.48 5.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.072 -0.714 . . . . 71.109999999999999 109.072 175.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 6.5 p -74.42 -18.97 60.57 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.909 -0.587 . . . . 62.420000000000002 111.964 -173.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.4 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 36.7 tpt85 -122.97 108.08 32.8 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.438 -0.346 . . . . 72.519999999999996 110.122 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.92 158.95 27.1 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 123.146 2.564 . . . . 61.240000000000002 112.48 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.61 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 94.9 mt -80.93 160.81 24.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.888 -0.596 . . . . 43.009999999999998 111.459 -174.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 461' ' ' GLU . . . . . 0.68 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 0.1 OUTLIER -65.91 139.59 58.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.652 -0.703 . . . . 71.430000000000007 112.069 -175.989 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -106.12 10.74 31.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.92 -1.037 . . . . 62.219999999999999 112.331 -173.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 463' ' ' GLN . . . . . 0.421 ' OE1' ' HG3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -120.63 153.03 37.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 119.685 -0.806 . . . . 51.229999999999997 112.362 -163.733 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.568 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.2 pt? -91.7 146.7 23.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.164 -1.38 . . . . 75.400000000000006 112.072 -169.097 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.499 HG21 HG22 ' A' ' 471' ' ' VAL . 28.2 m -125.32 178.43 3.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.822 -0.627 . . . . 64.129999999999995 111.121 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -118.36 161.65 19.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.095 -0.502 . . . . 73.319999999999993 110.775 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 52.7 t -66.17 126.59 25.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 74.030000000000001 110.738 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 95.13 -3.97 67.2 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.75 -0.738 . . . . 75.010000000000005 112.304 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -104.91 150.61 24.73 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.89 -0.411 . . . . 74.209999999999994 109.89 178.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 470' ' ' ARG . . . . . 0.463 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 17.3 ptp180 -81.58 153.19 26.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.984 0.421 . . . . 74.129999999999995 110.957 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.499 HG22 HG21 ' A' ' 465' ' ' VAL . 2.3 t -120.57 119.33 59.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.044 -0.525 . . . . 72.519999999999996 109.93 177.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -106.02 119.18 38.54 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.064 -0.347 . . . . 62.030000000000001 110.064 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.68 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 98.3 m-85 -108.85 139.31 43.86 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.884 -0.598 . . . . 64.349999999999994 110.28 174.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.95 123.85 50.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.544 -0.298 . . . . 73.219999999999999 110.31 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 26.8 p -149.39 135.44 18.94 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.912 0.387 . . . . 64.319999999999993 110.479 177.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.442 ' HA ' ' HA ' ' A' ' 509' ' ' ARG . 43.8 mt-10 -128.18 155.52 44.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.895 -0.593 . . . . 73.310000000000002 109.437 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.5 HG21 ' HB3' ' A' ' 482' ' ' ALA . 14.2 m -125.3 166.68 20.66 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 116.424 -0.353 . . . . 72.519999999999996 110.461 177.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 25.8 p -78.93 8.4 5.64 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.438 0.533 . . . . 61.210000000000001 112.438 -174.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 479' ' ' GLU . . . . . 0.566 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 37.1 tt0 -144.54 133.93 23.19 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.048 -0.353 . . . . 75.319999999999993 110.048 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -79.0 134.11 36.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.317 0.579 . . . . 72.019999999999996 110.731 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' GLY . . . . . 0.516 ' HA2' ' HD3' ' A' ' 505' ' ' LYS . . . 71.4 16.28 75.48 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.47 -0.786 . . . . 72.239999999999995 112.118 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.566 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -61.56 156.54 19.41 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.146 0.498 . . . . 61.0 111.821 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -81.25 133.6 35.47 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.344 -0.844 . . . . 63.030000000000001 109.878 -178.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.565 ' HB ' HD11 ' A' ' 527' ' ' LEU . 26.8 m -137.36 175.53 9.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.892 0.377 . . . . 73.430000000000007 110.858 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 485' ' ' LYS . . . . . 0.569 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 55.9 tttp -151.31 122.63 7.8 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.306 -0.627 . . . . 71.549999999999997 109.306 -177.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -101.92 120.1 39.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.858 0.361 . . . . 72.200000000000003 111.143 -176.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 487' ' ' LEU . . . . . 0.524 HD21 ' HE3' ' A' ' 485' ' ' LYS . 98.0 mt -120.45 135.51 55.03 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.911 -0.586 . . . . 73.150000000000006 110.411 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.413 ' HE2' ' HB3' ' A' ' 488' ' ' LYS . 5.2 tmmm? -111.88 104.77 13.09 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.572 -0.899 . . . . 73.140000000000001 108.572 174.112 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.31 36.66 16.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.598 -0.728 . . . . 65.319999999999993 110.877 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.08 -14.11 61.53 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.833 -0.698 . . . . 32.039999999999999 113.266 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 39.9 t -100.76 123.2 53.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 122.47 -0.429 . . . . 54.229999999999997 110.43 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' GLU . . . . . 0.422 ' HA ' HD23 ' A' ' 487' ' ' LEU . 39.3 tt0 -71.77 135.69 46.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.98 0.419 . . . . 73.040000000000006 110.78 -179.019 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 91.1 mt -78.42 128.26 33.36 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.953 -0.567 . . . . 74.010000000000005 110.125 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 11.8 t -80.88 138.9 36.17 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.13 0.49 . . . . 75.019999999999996 110.036 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 495' ' ' ARG . . . . . 0.605 ' HA ' HG23 ' A' ' 498' ' ' THR . 0.0 OUTLIER -126.02 14.24 7.9 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.834 -0.621 . . . . 73.450000000000003 110.043 -178.01 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -70.49 -34.22 72.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.478 0.656 . . . . 60.350000000000001 109.304 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -144.69 107.21 4.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.014 -0.994 . . . . 75.120000000000005 109.014 173.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.605 HG23 ' HA ' ' A' ' 495' ' ' ARG . 22.6 p -120.21 114.87 22.56 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.221 -0.445 . . . . 73.120000000000005 111.205 -176.1 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -111.82 -18.97 12.58 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.045 0.45 . . . . 71.049999999999997 111.039 170.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -99.38 -42.84 6.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.06 -0.518 . . . . 71.099999999999994 111.136 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.49 ' HB3' HD11 ' A' ' 512' ' ' LEU . 46.4 m-85 -107.64 138.54 43.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.368 -0.378 . . . . 74.310000000000002 110.611 -176.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 502' ' ' ARG . . . . . 0.524 ' HB2' ' CG2' ' A' ' 513' ' ' ILE . 0.8 OUTLIER -118.34 123.95 46.58 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.704 0.288 . . . . 73.299999999999997 110.418 175.91 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 503' ' ' PHE . . . . . 0.438 ' CE2' HD13 ' A' ' 512' ' ' LEU . 89.5 m-85 -103.1 112.84 25.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.743 -0.662 . . . . 72.230000000000004 109.615 178.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.559 ' HE2' HG22 ' A' ' 513' ' ' ILE . 0.0 OUTLIER -113.79 135.82 53.54 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.978 0.418 . . . . 71.129999999999995 111.005 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.516 ' HD3' ' HA2' ' A' ' 481' ' ' GLY . 20.4 ttmt -115.15 111.89 21.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.537 -0.756 . . . . 64.530000000000001 109.699 177.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 506' ' ' ASP . . . . . 0.422 ' HB2' ' HG2' ' A' ' 509' ' ' ARG . 32.3 m-20 -119.58 88.17 2.88 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.542 -0.54 . . . . 73.120000000000005 109.542 177.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.65 -106.45 1.76 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.611 -0.805 . . . . 55.420000000000002 112.107 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -101.54 -15.9 16.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.582 0.229 . . . . 54.25 110.701 -177.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.442 ' HA ' ' HA ' ' A' ' 476' ' ' GLU . 26.6 ptt180 -89.76 151.54 21.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.196 0.522 . . . . 74.239999999999995 110.219 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 -132.06 136.35 47.14 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.012 -0.736 . . . . 61.439999999999998 109.012 175.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -123.9 124.09 41.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.008 0.432 . . . . 63.520000000000003 111.473 177.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.49 HD11 ' HB3' ' A' ' 501' ' ' TYR . 53.1 tp -105.46 102.72 12.17 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.19 -1.041 . . . . 74.340000000000003 108.19 169.013 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.559 HG22 ' HE2' ' A' ' 504' ' ' LYS . 8.0 tp -98.68 113.2 32.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.668 0.746 . . . . 73.5 109.8 -179.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.463 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 60.5 mt -88.6 115.96 29.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.309 -0.86 . . . . 73.450000000000003 109.365 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -63.81 -45.37 89.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.882 0.372 . . . . 73.209999999999994 111.056 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -141.83 110.91 6.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.95 -0.568 . . . . 63.240000000000002 110.074 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -83.29 137.14 34.11 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.09 -0.505 . . . . 73.329999999999998 110.953 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 518' ' ' MET . . . . . 0.596 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 26.3 mmt -107.72 170.78 7.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.919 -0.582 . . . . 70.239999999999995 110.086 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.565 HD22 ' H ' ' A' ' 519' ' ' LEU . 2.4 mm? -64.07 -54.68 30.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.178 0.513 . . . . 73.099999999999994 110.808 -173.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -82.77 -4.84 58.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.645 -0.707 . . . . 74.340000000000003 111.089 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' ASP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 1.0 OUTLIER -89.3 -7.49 55.28 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.081 -0.508 . . . . 74.439999999999998 111.509 -178.496 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.637 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -74.4 -43.72 55.16 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.76 -0.376 . . . . 53.25 111.371 -177.736 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 41.41 -158.11 0.04 OUTLIER Glycine 0 CA--C 1.526 0.767 0 CA-C-O 121.95 0.75 . . . . 72.120000000000005 114.845 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -111.51 113.79 26.45 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.07 -0.715 . . . . 73.239999999999995 109.07 169.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 525' ' ' TYR . . . . . 0.594 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 60.6 m-85 -84.35 130.95 34.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.083 0.468 . . . . 64.25 110.207 -178.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -137.87 119.65 15.21 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.657 -0.701 . . . . 71.299999999999997 110.276 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.565 HD11 ' HB ' ' A' ' 484' ' ' VAL . 33.7 tp -89.78 109.59 20.57 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.255 -0.646 . . . . 73.209999999999994 109.255 178.144 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 528' ' ' CYS . . . . . 0.569 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 60.3 m -94.83 113.97 25.78 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.302 0.572 . . . . 75.129999999999995 110.24 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.511 HG22 HG12 ' A' ' 484' ' ' VAL . 55.8 p -116.13 -165.92 1.09 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.408 -0.815 . . . . 75.530000000000001 110.973 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 530' ' ' SER . . . . . 0.53 ' HB2' ' HB ' ' A' ' 454' ' ' VAL . 33.1 m -52.87 5.05 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.451 1.1 . . . . 54.509999999999998 113.729 172.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 531' ' ' GLY . . . . . 0.511 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.79 27.44 1.91 Allowed Glycine 0 C--N 1.33 0.224 0 O-C-N 122.018 -0.426 . . . . 75.150000000000006 113.357 -177.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -111.75 134.58 12.18 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 109.658 -1.377 . . . . 72.430000000000007 109.658 164.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -119.09 120.54 37.45 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 117.193 0.496 . . . . 62.0 111.685 -172.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -121.3 143.3 49.25 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.799 -0.815 . . . . 43.119999999999997 108.799 171.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.437 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.4 tm? -128.54 133.56 48.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.001 0.429 . . . . 53.0 110.384 -174.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.61 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -127.65 131.11 49.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.915 -0.584 . . . . 54.210000000000001 110.272 176.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -113.49 115.7 28.43 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.19 -0.671 . . . . 44.32 109.19 176.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.475 HD11 HG22 ' A' ' 465' ' ' VAL . 37.6 tp -109.46 134.61 51.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.991 -0.55 . . . . 71.450000000000003 110.349 -173.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.512 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 43.1 mt -119.86 113.69 41.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.375 -0.602 . . . . 75.209999999999994 109.375 175.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.637 HG23 ' HB2' ' A' ' 522' ' ' ALA . 85.7 t -103.89 134.66 44.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.831 -0.433 . . . . 72.439999999999998 109.831 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.36 146.07 49.58 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.295 -0.411 . . . . 74.019999999999996 110.057 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -83.4 109.31 17.21 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.939 -0.763 . . . . 70.040000000000006 108.939 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 543' ' ' LYS . . . . . 0.785 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 10.9 mmpt? . . . . . 0 C--O 1.245 0.846 0 CA-C-O 118.306 -0.854 . . . . 72.329999999999998 109.753 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.764 0 N-CA-C 112.384 -0.286 . . . . 64.140000000000001 112.384 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 40.0 m -114.89 84.26 2.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.914 0.387 . . . . 51.399999999999999 110.409 176.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.85 41.41 0.29 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.201 0.524 . . . . 73.230000000000004 110.567 177.482 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 51.9 mtm -114.75 107.32 50.78 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.71 -0.677 . . . . 64.150000000000006 109.927 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -64.28 133.88 39.69 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 121.859 1.706 . . . . 72.420000000000002 110.04 172.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.418 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 92.2 t -64.36 107.6 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.37 0.605 . . . . 72.439999999999998 110.213 -176.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 44.1 tp -106.14 162.38 13.68 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.165 -0.925 . . . . 74.209999999999994 109.465 -177.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 34.1 mt -104.58 107.54 22.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 110.041 -0.355 . . . . 72.430000000000007 110.041 -177.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 457' ' ' THR . . . . . 0.5 ' O ' ' HD3' ' A' ' 459' ' ' PRO . 21.4 p -80.57 -44.01 19.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.316 0.579 . . . . 72.329999999999998 110.367 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.46 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 8.1 tpt85 -99.79 101.63 14.48 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 115.383 -0.826 . . . . 72.239999999999995 109.18 175.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 459' ' ' PRO . . . . . 0.5 ' HD3' ' O ' ' A' ' 457' ' ' THR . 17.0 Cg_exo -67.36 165.18 27.83 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.726 2.284 . . . . 65.430000000000007 111.493 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.694 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 3.2 mm? -65.86 166.45 11.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.357 -0.383 . . . . 75.439999999999998 110.395 -179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 461' ' ' GLU . . . . . 0.406 ' OE1' ' HA ' ' A' ' 461' ' ' GLU . 1.4 tp10 -69.87 157.17 37.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.481 0.657 . . . . 75.420000000000002 112.255 -172.083 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -105.49 7.67 33.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.883 -1.053 . . . . 63.149999999999999 113.649 -168.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -123.41 153.63 40.14 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.162 -1.015 . . . . 72.450000000000003 112.423 -167.678 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.658 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 1.8 pt? -108.75 145.47 35.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.177 -1.374 . . . . 72.329999999999998 110.89 -171.437 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.56 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 27.5 m -124.19 176.83 5.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.078 0.466 . . . . 73.439999999999998 111.21 -178.368 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -100.14 166.7 10.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.786 -0.643 . . . . 65.319999999999993 110.358 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 467' ' ' VAL . . . . . 0.419 HG21 ' HG2' ' A' ' 542' ' ' GLU . 24.5 t -60.03 138.25 21.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.329 -0.396 . . . . 73.430000000000007 111.254 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 82.18 -4.05 78.25 Favored Glycine 0 C--N 1.329 0.185 0 C-N-CA 121.192 -0.528 . . . . 55.25 112.809 176.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 56.6 tt0 -102.46 143.32 32.34 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.181 -0.303 . . . . 75.439999999999998 110.181 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 470' ' ' ARG . . . . . 0.52 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 1.1 ptp180 -72.02 147.98 46.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.269 -0.423 . . . . 72.129999999999995 110.885 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.487 ' HB ' HG21 ' A' ' 465' ' ' VAL . 7.5 p -140.91 133.71 31.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.999 -0.546 . . . . 53.109999999999999 109.684 174.462 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.625 ' HG2' HD13 ' A' ' 513' ' ' ILE . 44.3 mt-10 -100.95 132.48 46.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.017 0.437 . . . . 71.549999999999997 110.968 -178.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.549 ' HB3' HD12 ' A' ' 460' ' ' LEU . 80.6 m-85 -124.09 112.28 16.94 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.042 -0.725 . . . . 74.010000000000005 109.042 169.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -118.52 138.65 52.38 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.102 0.477 . . . . 60.43 110.619 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.476 ' HB3' HD13 ' A' ' 460' ' ' LEU . 7.4 p -138.91 146.38 41.0 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.628 -0.714 . . . . 42.420000000000002 110.518 -178.03 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.608 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 44.3 mt-10 -116.38 138.08 51.64 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.213 -0.448 . . . . 73.140000000000001 109.821 176.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.473 HG21 ' HB3' ' A' ' 482' ' ' ALA . 14.2 m -119.27 164.83 15.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.86 -0.609 . . . . 74.129999999999995 110.874 -179.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 7.9 m -66.19 -12.87 58.75 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.723 0.638 . . . . 62.140000000000001 112.723 -174.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 479' ' ' GLU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 40.8 tt0 -129.33 145.23 51.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.733 0.301 . . . . 75.129999999999995 110.847 -176.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 480' ' ' GLU . . . . . 0.525 ' H ' ' CD ' ' A' ' 480' ' ' GLU . 0.6 OUTLIER -79.69 126.95 31.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.188 -0.46 . . . . 72.120000000000005 110.541 -179.317 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 64.0 25.86 69.75 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.962 -0.637 . . . . 62.219999999999999 112.049 -176.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.602 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -58.44 152.9 16.92 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.148 0.499 . . . . 63.039999999999999 112.129 -177.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -76.32 111.95 12.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.26 -0.882 . . . . 65.310000000000002 109.875 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.6 ' HB ' HD11 ' A' ' 527' ' ' LEU . 35.2 m -124.98 150.72 30.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.172 -0.467 . . . . 64.150000000000006 111.077 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 485' ' ' LYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 528' ' ' CYS . 45.4 tttp -121.86 129.72 52.81 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.177 -0.675 . . . . 62.119999999999997 109.177 179.308 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -101.17 126.84 47.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.644 0.259 . . . . 73.510000000000005 110.477 -178.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' LEU . . . . . 0.43 HD11 ' HD3' ' A' ' 485' ' ' LYS . 5.1 mp -131.44 150.96 51.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.355 0.598 . . . . 53.549999999999997 111.194 -179.492 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.585 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 5.8 tmmm? -129.6 107.78 9.71 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.95 -1.023 . . . . 73.310000000000002 108.517 173.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.93 35.28 26.16 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.036 -0.529 . . . . 74.239999999999995 111.328 -176.399 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 95.96 -20.91 47.85 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.952 -0.642 . . . . 75.209999999999994 112.735 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 62.1 t -85.02 122.84 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 110.225 -0.287 . . . . 74.549999999999997 110.225 -177.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -69.06 132.18 46.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.344 -0.389 . . . . 75.409999999999997 110.651 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 79.9 mt -87.11 104.72 16.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.83 -0.623 . . . . 51.229999999999997 110.07 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 9.7 t -69.64 160.94 30.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.304 0.573 . . . . 63.420000000000002 111.206 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 495' ' ' ARG . . . . . 0.606 ' HA ' HG23 ' A' ' 498' ' ' THR . 0.0 OUTLIER -117.84 -3.45 11.21 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.624 -0.717 . . . . 75.299999999999997 109.5 179.689 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -60.82 -39.18 88.01 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.253 -0.885 . . . . 61.140000000000001 110.397 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 497' ' ' GLU . . . . . 0.423 ' O ' ' HG3' ' A' ' 497' ' ' GLU . 8.1 pt-20 -127.55 108.26 10.64 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.101 -0.704 . . . . 62.200000000000003 109.101 167.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.606 HG23 ' HA ' ' A' ' 495' ' ' ARG . 0.7 OUTLIER -122.29 88.0 2.85 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.389 0.614 . . . . 64.5 111.235 -176.593 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -100.91 -27.4 13.33 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.42 -0.809 . . . . 62.140000000000001 109.078 175.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -95.43 -47.32 6.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.208 -0.906 . . . . 65.329999999999998 111.026 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.455 ' O ' ' HD2' ' A' ' 502' ' ' ARG . 13.8 m-85 -103.21 148.41 25.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.2 -0.455 . . . . 74.310000000000002 110.622 -176.089 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 502' ' ' ARG . . . . . 0.455 ' HD2' ' O ' ' A' ' 501' ' ' TYR . 1.5 mpt_? -132.58 137.69 47.17 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.558 -0.534 . . . . 75.329999999999998 109.558 171.138 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -111.94 118.55 35.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.654 0.264 . . . . 72.150000000000006 110.799 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 1.4 mptm? -111.83 145.37 39.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.68 0.276 . . . . 72.129999999999995 110.354 176.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -123.35 117.57 25.52 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.318 -0.401 . . . . 62.409999999999997 110.787 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 506' ' ' ASP . . . . . 0.472 ' HB2' ' HG3' ' A' ' 509' ' ' ARG . 42.2 m-20 -121.27 77.7 1.35 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.631 -0.507 . . . . 73.230000000000004 109.631 173.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 64.84 -109.26 2.75 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.648 -0.786 . . . . 43.409999999999997 112.034 -178.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -85.91 -24.66 26.52 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.769 -0.254 . . . . 71.010000000000005 111.091 -177.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.608 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 29.6 ptt180 -92.95 132.41 37.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.616 0.722 . . . . 54.210000000000001 110.93 -177.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -114.94 143.98 44.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.519 -0.764 . . . . 72.439999999999998 109.28 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 511' ' ' HIS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 25.6 m-70 -119.22 127.62 53.44 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.844 -0.343 . . . . 71.140000000000001 110.803 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.412 HD11 ' HB3' ' A' ' 501' ' ' TYR . 65.4 tp -107.03 102.94 12.25 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.363 -0.977 . . . . 70.420000000000002 108.363 168.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.625 HD13 ' HG2' ' A' ' 472' ' ' GLU . 5.8 tp -103.47 115.46 45.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.518 0.675 . . . . 63.200000000000003 110.242 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.52 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 34.0 mt -95.27 112.74 28.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.631 -0.713 . . . . 53.210000000000001 109.221 177.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -73.76 -43.12 59.97 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.076 0.465 . . . . 73.340000000000003 110.048 -176.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -128.67 108.54 10.57 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.548 -0.751 . . . . 73.209999999999994 109.519 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.403 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -91.48 138.23 31.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.109 -0.496 . . . . 53.140000000000001 110.25 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 26.5 mmt -118.84 175.18 5.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.203 -0.453 . . . . 61.210000000000001 110.012 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.414 HD22 ' H ' ' A' ' 519' ' ' LEU . 3.0 mm? -64.99 -53.91 38.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.34 -0.391 . . . . 64.340000000000003 111.089 -173.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -80.01 -18.5 50.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.128 0.49 . . . . 73.109999999999999 110.716 -178.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.29 -33.34 71.45 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.048 -0.524 . . . . 64.25 111.755 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.554 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -64.4 -44.5 91.08 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.865 0.32 . . . . 71.109999999999999 111.865 -175.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 523' ' ' GLY . . . . . 0.585 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 40.47 -157.55 0.03 OUTLIER Glycine 0 CA--C 1.525 0.673 0 O-C-N 123.911 0.757 . . . . 43.219999999999999 114.818 175.032 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 53.7 m80 -105.88 112.45 25.51 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.471 -0.937 . . . . 72.420000000000002 108.471 169.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -85.45 131.45 34.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.259 0.552 . . . . 71.439999999999998 111.262 -175.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.28 131.42 34.4 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.301 -0.863 . . . . 75.120000000000005 110.558 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.6 HD11 ' HB ' ' A' ' 484' ' ' VAL . 37.3 tp -99.62 115.16 28.77 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.438 -0.578 . . . . 74.230000000000004 109.438 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 528' ' ' CYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 485' ' ' LYS . 48.4 t -100.16 112.87 25.2 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.702 -0.481 . . . . 74.329999999999998 109.702 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.522 ' C ' ' H ' ' A' ' 531' ' ' GLY . 61.2 p -111.51 -165.0 0.95 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.886 -0.597 . . . . 70.299999999999997 110.625 -178.134 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 11.9 m -51.09 6.06 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.611 1.164 . . . . 73.5 113.961 171.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 531' ' ' GLY . . . . . 0.522 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.42 28.88 1.54 Allowed Glycine 0 C--N 1.332 0.348 0 O-C-N 121.952 -0.467 . . . . 53.340000000000003 113.253 -175.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -113.4 141.76 17.1 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 109.974 -1.25 . . . . 74.319999999999993 109.974 167.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -128.84 121.96 29.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.461 0.63 . . . . 63.109999999999999 112.096 -173.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -131.14 132.16 44.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.581 -0.736 . . . . 55.130000000000003 109.274 170.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -118.81 124.38 47.05 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.032 -0.358 . . . . 61.109999999999999 110.032 -176.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.694 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -118.69 159.13 24.2 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.136 -0.484 . . . . 52.310000000000002 110.215 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -127.36 123.12 35.51 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.92 0.391 . . . . 72.129999999999995 110.815 -176.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 464' ' ' LEU . 54.8 tp -112.12 121.48 45.08 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.878 -0.601 . . . . 75.219999999999999 109.723 176.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.658 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.5 mp -108.26 107.66 23.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 109.016 -0.735 . . . . 74.540000000000006 109.016 176.045 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 465' ' ' VAL . 42.2 t -94.79 122.82 46.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.32 0.581 . . . . 74.319999999999993 110.37 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 541' ' ' GLN . . . . . 0.474 ' HB3' ' HE3' ' A' ' 543' ' ' LYS . 58.3 mt-30 -114.64 160.54 19.21 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.98 -1.009 . . . . 74.310000000000002 110.166 -176.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 542' ' ' GLU . . . . . 0.419 ' HG2' HG21 ' A' ' 467' ' ' VAL . 46.6 mt-10 -105.95 106.76 17.42 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.949 -0.76 . . . . 64.439999999999998 108.949 174.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 543' ' ' LYS . . . . . 0.474 ' HE3' ' HB3' ' A' ' 541' ' ' GLN . 17.2 ptpt . . . . . 0 C--O 1.245 0.854 0 CA-C-N 116.293 -0.412 . . . . 42.340000000000003 110.137 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.781 0 N-CA-C 111.918 -0.473 . . . . 53.409999999999997 111.918 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 5.7 m -111.15 148.16 33.35 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.617 -0.512 . . . . 63.25 109.617 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 -65.05 119.96 11.76 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.059 -0.719 . . . . 62.240000000000002 109.059 173.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 21.6 ptm -69.55 138.35 88.62 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 116.181 -0.463 . . . . 74.409999999999997 111.166 -174.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.83 132.9 22.49 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.21 1.94 . . . . 74.409999999999997 109.656 168.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.538 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 55.1 t -68.52 106.69 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 120.889 0.376 . . . . 53.340000000000003 110.158 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 52.6 tp -87.64 138.75 31.2 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.943 -0.571 . . . . 73.400000000000006 110.348 -178.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.479 HD13 HD23 ' A' ' 527' ' ' LEU . 32.7 mt -91.75 113.3 26.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.563 -0.744 . . . . 71.230000000000004 109.458 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 457' ' ' THR . . . . . 0.453 ' OG1' ' HB2' ' A' ' 476' ' ' GLU . 28.6 p -77.29 -45.86 24.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.929 0.395 . . . . 74.030000000000001 110.808 -176.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.46 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 12.1 tpt180 -92.1 111.03 48.09 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.994 -0.548 . . . . 61.329999999999998 109.857 176.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -68.81 149.67 73.01 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.491 2.127 . . . . 65.140000000000001 111.109 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.781 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 4.0 mm? -66.2 158.94 27.51 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.316 -0.402 . . . . 75.420000000000002 110.792 -178.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 461' ' ' GLU . . . . . 0.528 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 1.8 mp0 -65.12 144.41 57.25 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.97 0.891 . . . . 44.25 112.709 -172.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -104.77 9.13 35.07 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.049 -1.432 . . . . 74.329999999999998 111.729 -174.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 463' ' ' GLN . . . . . 0.505 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -121.44 154.36 36.65 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 122.214 1.006 . . . . 73.409999999999997 112.894 -160.256 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.494 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.1 pt? -90.86 147.08 23.41 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 113.4 -1.727 . . . . 64.310000000000002 112.206 -167.144 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.556 HG23 HG22 ' A' ' 540' ' ' VAL . 27.4 m -126.68 178.0 4.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.45 -0.795 . . . . 71.420000000000002 110.076 175.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 466' ' ' MET . . . . . 0.405 ' HB3' ' HG3' ' A' ' 543' ' ' LYS . 51.4 mtm -118.16 158.65 24.69 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.245 -0.434 . . . . 64.25 110.82 -178.008 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 51.4 t -50.95 128.6 8.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.653 -0.703 . . . . 72.120000000000005 111.72 -176.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 89.39 -16.04 57.06 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 115.838 -0.619 . . . . 72.049999999999997 113.337 174.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -83.17 135.09 34.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 117.038 0.419 . . . . 74.549999999999997 110.792 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 470' ' ' ARG . . . . . 0.538 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 2.0 ptm180 -66.33 126.52 29.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.63 -0.714 . . . . 70.299999999999997 110.61 175.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.506 ' HB ' HG11 ' A' ' 465' ' ' VAL . 5.2 p -113.16 137.94 44.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.749 -0.463 . . . . 72.340000000000003 109.749 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.467 ' HB2' ' NH2' ' A' ' 470' ' ' ARG . 30.4 tt0 -120.49 124.02 44.39 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.785 -0.643 . . . . 72.319999999999993 110.515 -173.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.528 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 97.4 m-85 -110.28 141.07 43.78 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.905 -0.589 . . . . 71.129999999999995 109.557 176.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -119.2 134.97 54.9 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.903 0.382 . . . . 73.010000000000005 110.234 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 27.1 p -146.93 126.55 13.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.368 -0.378 . . . . 61.219999999999999 110.392 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.46 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 31.4 mt-10 -110.77 137.66 48.14 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.82 -0.807 . . . . 75.030000000000001 108.82 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 508' ' ' GLN . 27.8 m -119.48 152.63 22.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 C-N-CA 120.562 -0.455 . . . . 71.430000000000007 110.653 177.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 16.1 m -66.68 -26.04 66.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.66 -0.7 . . . . 61.450000000000003 111.718 -175.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 479' ' ' GLU . . . . . 0.423 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 37.8 tt0 -106.42 118.18 35.98 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.865 -0.42 . . . . 70.530000000000001 109.865 -178.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 480' ' ' GLU . . . . . 0.826 ' HB3' ' HG2' ' A' ' 508' ' ' GLN . 10.0 pt-20 -76.19 134.34 39.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.093 0.473 . . . . 73.450000000000003 110.893 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 72.68 21.18 79.78 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.696 -0.684 . . . . 63.5 112.092 -176.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.423 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -73.28 150.84 41.64 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.88 0.372 . . . . 74.299999999999997 111.452 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -81.72 114.53 20.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.551 -0.75 . . . . 52.020000000000003 110.438 178.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.582 HG12 HG22 ' A' ' 529' ' ' THR . 21.2 m -125.84 150.64 31.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 70.450000000000003 109.862 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 485' ' ' LYS . . . . . 0.508 ' HE2' HD11 ' A' ' 487' ' ' LEU . 21.0 ptmt -125.61 140.44 52.73 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.065 0.459 . . . . 74.230000000000004 110.749 177.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -102.01 125.78 48.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.621 -0.718 . . . . 72.219999999999999 110.222 -179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 487' ' ' LEU . . . . . 0.508 HD11 ' HE2' ' A' ' 485' ' ' LYS . 5.7 mp -114.13 136.4 52.98 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.063 -0.517 . . . . 55.009999999999998 110.379 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.15 105.46 12.62 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.813 -1.181 . . . . 72.140000000000001 107.813 174.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 57.12 34.04 24.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.993 -0.549 . . . . 64.450000000000003 110.691 -174.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.25 -18.88 56.65 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.001 -0.619 . . . . 44.340000000000003 112.906 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 45.5 t -83.09 127.45 39.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 110.328 -0.249 . . . . 50.130000000000003 110.328 -178.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -72.24 126.56 30.12 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.47 -0.567 . . . . 73.409999999999997 109.47 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.472 HD11 ' HE2' ' A' ' 525' ' ' TYR . 77.3 mt -66.04 106.43 1.61 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.141 0.496 . . . . 74.219999999999999 110.641 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 9.8 t -73.45 141.52 46.87 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 115.586 -0.734 . . . . 74.25 110.751 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 495' ' ' ARG . . . . . 0.466 ' HD3' ' N ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -107.7 13.12 26.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.694 -0.685 . . . . 73.129999999999995 110.264 -179.04 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -59.96 -56.61 19.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.8 -0.637 . . . . 60.340000000000003 109.644 174.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -137.78 118.39 13.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.729 -0.668 . . . . 75.400000000000006 109.913 173.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.2 108.56 5.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.076 -0.511 . . . . 72.209999999999994 110.42 -178.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -104.47 -22.22 13.33 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.284 0.564 . . . . 74.230000000000004 110.098 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -92.87 -34.47 13.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.744 -0.662 . . . . 73.109999999999999 111.611 -177.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.412 ' HD1' HG12 ' A' ' 514' ' ' ILE . 8.0 m-85 -115.77 141.51 48.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.617 -0.265 . . . . 73.030000000000001 110.309 -174.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -132.52 126.42 32.86 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.87 0.366 . . . . 74.209999999999994 110.128 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -96.43 113.63 25.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.803 -0.635 . . . . 71.310000000000002 110.819 -174.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 42.1 mttm -109.64 124.41 51.13 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.101 -0.5 . . . . 60.030000000000001 111.246 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -103.92 111.15 23.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.022 -0.535 . . . . 75.310000000000002 109.984 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 506' ' ' ASP . . . . . 0.401 ' O ' ' HG2' ' A' ' 509' ' ' ARG . 4.9 m-20 -120.03 87.09 2.68 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.124 0.488 . . . . 72.510000000000005 110.2 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 63.4 -105.51 1.08 Allowed Glycine 0 N--CA 1.449 -0.448 0 CA-C-N 115.638 -0.71 . . . . 71.420000000000002 112.843 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.826 ' HG2' ' HB3' ' A' ' 480' ' ' GLU . 66.8 mt-30 -93.1 -25.18 18.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.767 0.318 . . . . 65.099999999999994 110.871 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.401 ' HG2' ' O ' ' A' ' 506' ' ' ASP . 16.9 ptp180 -96.43 153.4 17.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.352 0.596 . . . . 73.230000000000004 111.002 -175.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -127.1 123.06 35.98 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.72 -0.673 . . . . 64.310000000000002 109.268 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 511' ' ' HIS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 56.3 m-70 -101.52 118.3 36.67 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.989 -0.374 . . . . 71.209999999999994 109.989 -177.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 61.5 tp -104.29 106.69 17.28 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.265 -0.642 . . . . 74.430000000000007 109.265 173.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 9.2 tp -104.92 128.77 58.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.992 -0.549 . . . . 75.140000000000001 110.133 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 34.2 mt -104.54 114.3 43.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.204 -0.665 . . . . 53.25 109.204 175.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -58.23 -52.64 64.74 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.547 0.529 . . . . 44.509999999999998 111.435 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -137.74 109.64 7.17 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.722 -0.473 . . . . 73.349999999999994 109.722 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -76.19 127.38 32.8 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.953 -0.567 . . . . 71.019999999999996 111.238 -178.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 14.9 mmt -97.51 175.43 6.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.836 -0.62 . . . . 60.149999999999999 109.678 176.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.2 -53.36 25.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.952 0.406 . . . . 72.349999999999994 110.805 -178.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -71.32 -27.89 63.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.072 -0.513 . . . . 73.109999999999999 111.034 -177.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -77.83 -3.44 41.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.516 -0.766 . . . . 52.32 111.857 -173.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.55 ' HA ' HD23 ' A' ' 538' ' ' LEU . . . -74.37 -43.2 57.54 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.498 -0.481 . . . . 52.5 109.918 177.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 38.28 -158.55 0.01 OUTLIER Glycine 0 C--N 1.339 0.734 0 O-C-N 124.457 1.098 . . . . 44.299999999999997 115.557 172.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -114.05 108.86 17.57 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.307 -0.627 . . . . 73.519999999999996 109.307 169.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 525' ' ' TYR . . . . . 0.472 ' HE2' HD11 ' A' ' 493' ' ' LEU . 32.1 m-85 -85.63 133.86 34.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.964 0.411 . . . . 73.409999999999997 111.087 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -134.35 128.78 34.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.924 -0.58 . . . . 64.439999999999998 110.545 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.479 HD23 HD13 ' A' ' 456' ' ' ILE . 63.4 tp -99.86 111.98 24.27 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.84 -0.43 . . . . 73.519999999999996 109.84 176.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 70.8 m -104.79 126.08 51.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.299 0.571 . . . . 55.25 110.914 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.582 HG22 HG12 ' A' ' 484' ' ' VAL . 30.1 p -115.79 -165.52 1.05 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.341 -0.845 . . . . 72.409999999999997 110.119 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 530' ' ' SER . . . . . 0.466 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 14.7 m -50.77 7.43 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.859 1.264 . . . . 73.319999999999993 114.173 171.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 531' ' ' GLY . . . . . 0.535 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 122.14 28.18 1.55 Allowed Glycine 0 C--N 1.331 0.266 0 O-C-N 122.007 -0.433 . . . . 54.329999999999998 113.245 -174.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -117.76 138.37 13.96 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.603 -1.399 . . . . 12.41 109.603 163.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -129.35 127.92 42.04 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 117.463 0.632 . . . . 73.310000000000002 112.103 -171.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -136.62 136.45 39.18 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.485 -0.78 . . . . 74.109999999999999 109.551 171.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 33.3 tp -109.09 145.24 36.0 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.817 0.341 . . . . 62.210000000000001 111.029 -176.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.781 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -123.72 132.46 53.82 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.092 -0.504 . . . . 71.439999999999998 110.324 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -110.41 115.92 30.51 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.77 -0.456 . . . . 71.340000000000003 109.77 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.555 HD11 HG22 ' A' ' 465' ' ' VAL . 35.7 tp -108.64 121.07 44.25 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.058 -0.519 . . . . 75.109999999999999 109.723 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 539' ' ' ILE . 4.5 mp -109.98 116.64 52.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.228 -0.656 . . . . 73.129999999999995 109.228 177.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.556 HG22 HG23 ' A' ' 465' ' ' VAL . 90.1 t -114.1 128.44 71.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.92 0.391 . . . . 72.019999999999996 110.257 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.46 169.65 14.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.048 -0.524 . . . . 62.340000000000003 109.894 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.53 141.31 39.67 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.532 -0.758 . . . . 72.319999999999993 110.642 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 543' ' ' LYS . . . . . 0.449 ' HE3' ' HB2' ' A' ' 543' ' ' LYS . 33.2 mtmt . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.398 -0.811 . . . . 72.200000000000003 110.033 176.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.621 0 N-CA-C 111.818 -0.513 . . . . 53.140000000000001 111.818 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 21.5 p -135.25 142.89 46.03 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 110.188 -0.301 . . . . 73.340000000000003 110.188 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -79.8 111.98 16.64 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.785 -0.45 . . . . 61.32 109.785 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' MET . . . . . 0.462 ' HA ' ' HD3' ' A' ' 453' ' ' PRO . 23.6 ptm -66.05 126.88 92.69 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.928 -0.578 . . . . 74.319999999999993 111.394 -176.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 453' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 452' ' ' MET . 1.4 Cg_endo -84.76 159.77 12.13 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 C-N-CA 122.798 2.332 . . . . 73.109999999999999 110.391 170.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.554 ' HB ' ' HB ' ' A' ' 529' ' ' THR . 58.5 t -78.18 107.35 10.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 108.979 -0.749 . . . . 62.119999999999997 108.979 178.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 455' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 477' ' ' VAL . 62.0 tp -84.91 124.17 31.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.733 -0.667 . . . . 73.319999999999993 110.753 -173.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.524 HD13 HD23 ' A' ' 527' ' ' LEU . 29.3 mt -91.01 98.9 8.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.71 -0.677 . . . . 72.420000000000002 109.998 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 33.8 p -79.19 -16.04 57.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 72.439999999999998 111.088 -176.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.474 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 19.2 tpt85 -130.38 102.03 17.21 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.904 -0.589 . . . . 72.439999999999998 109.717 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 459' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 458' ' ' ARG . 29.7 Cg_endo -63.62 167.73 12.89 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 123.224 2.616 . . . . 74.400000000000006 112.078 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.799 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 3.2 mm? -71.1 172.59 8.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.077 -0.51 . . . . 73.409999999999997 110.906 -177.155 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 461' ' ' GLU . . . . . 0.906 ' HG2' ' HA ' ' A' ' 473' ' ' PHE . 13.5 mm-40 -67.78 152.8 45.0 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.787 -0.642 . . . . 71.329999999999998 112.488 -176.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -105.53 6.51 32.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.315 -0.857 . . . . 70.430000000000007 112.454 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.7 154.53 39.29 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.89 0.852 . . . . 71.439999999999998 113.008 -162.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.653 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.0 pt? -103.9 146.84 28.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.185 -1.37 . . . . 74.519999999999996 111.808 -170.12 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.567 HG11 ' HB ' ' A' ' 471' ' ' VAL . 27.5 m -123.71 178.87 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-O 121.079 0.466 . . . . 44.310000000000002 111.265 -177.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 10.4 mtm -112.32 161.61 16.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.377 -0.374 . . . . 65.400000000000006 111.295 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 467' ' ' VAL . . . . . 0.48 HG21 ' HG2' ' A' ' 542' ' ' GLU . 59.6 t -56.72 129.67 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 115.955 -0.566 . . . . 52.350000000000001 112.178 -176.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 86.12 7.7 79.86 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.72 -0.673 . . . . 75.409999999999997 113.208 174.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -116.73 133.01 56.53 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.799 0.299 . . . . 63.350000000000001 110.306 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 470' ' ' ARG . . . . . 0.579 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 5.3 ptm180 -74.02 131.86 41.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.301 0.572 . . . . 72.5 112.1 -175.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.567 ' HB ' HG11 ' A' ' 465' ' ' VAL . 7.5 p -115.37 146.33 19.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.205 -0.907 . . . . 71.549999999999997 109.714 176.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -123.03 129.17 51.16 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.381 -0.229 . . . . 75.120000000000005 110.381 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.906 ' HA ' ' HG2' ' A' ' 461' ' ' GLU . 96.0 m-85 -106.45 124.89 50.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.437 -0.579 . . . . 74.450000000000003 109.437 174.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -100.25 131.48 46.16 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.085 -0.339 . . . . 73.030000000000001 110.085 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.452 ' HB3' HD13 ' A' ' 460' ' ' LEU . 18.2 p -141.4 118.05 10.98 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.091 0.472 . . . . 45.420000000000002 110.555 177.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.637 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 39.7 mt-10 -107.39 138.58 43.33 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.853 -0.612 . . . . 71.420000000000002 109.747 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 455' ' ' LEU . 28.2 m -132.57 174.06 13.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.297 -0.411 . . . . 71.120000000000005 110.767 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 16.7 p -85.77 8.37 20.2 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.482 0.549 . . . . 74.299999999999997 112.482 -175.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 479' ' ' GLU . . . . . 0.56 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 41.2 tt0 -126.82 134.83 50.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.6 0.238 . . . . 64.310000000000002 110.631 -177.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 480' ' ' GLU . . . . . 0.512 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 0.4 OUTLIER -81.83 128.27 33.85 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.555 -0.535 . . . . 73.230000000000004 109.555 179.15 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 60.27 32.79 77.89 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.165 -1.017 . . . . 62.549999999999997 110.879 -171.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.56 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -50.71 141.67 12.5 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 113.145 0.794 . . . . 75.510000000000005 113.145 -174.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 12.3 mp0 -74.79 103.7 5.14 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.126 -0.943 . . . . 73.299999999999997 109.813 175.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.559 HG12 HG22 ' A' ' 529' ' ' THR . 34.3 m -121.51 150.11 24.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.931 -0.577 . . . . 73.219999999999999 110.836 -177.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 47.1 tttp -123.27 126.86 47.7 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.213 -0.662 . . . . 73.209999999999994 109.213 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 486' ' ' TRP . . . . . 0.461 ' HB3' HD12 ' A' ' 493' ' ' LEU . 95.3 m95 -101.39 125.29 48.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.605 -0.27 . . . . 62.119999999999997 110.638 -177.475 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 487' ' ' LEU . . . . . 0.441 HD13 ' SG ' ' A' ' 528' ' ' CYS . 6.5 mp -128.12 144.07 51.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.065 0.459 . . . . 75.409999999999997 110.77 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.481 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 5.8 tmmm? -124.19 106.78 10.58 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.363 -0.977 . . . . 65.140000000000001 108.363 174.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 52.21 36.01 18.23 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.749 0.656 . . . . 73.239999999999995 111.693 -175.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.02 -20.07 51.73 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.869 -0.681 . . . . 34.009999999999998 112.921 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 43.4 t -86.64 123.79 39.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 110.092 -0.336 . . . . 63.439999999999998 110.092 -179.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -70.6 134.28 47.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.094 0.473 . . . . 70.030000000000001 110.804 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.461 HD12 ' HB3' ' A' ' 486' ' ' TRP . 52.2 mt -82.73 103.22 12.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.767 -0.651 . . . . 74.519999999999996 109.411 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 7.0 t -65.15 145.52 56.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 73.099999999999994 111.631 -177.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.62 9.5 17.88 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.149 -0.932 . . . . 70.219999999999999 109.482 176.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.32 -44.41 16.24 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.723 -0.671 . . . . 72.200000000000003 110.04 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 497' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 497' ' ' GLU . 7.0 pt-20 -143.16 110.08 5.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.314 0.578 . . . . 73.329999999999998 109.573 171.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.544 HG21 ' HB2' ' A' ' 501' ' ' TYR . 0.3 OUTLIER -142.76 109.54 5.47 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.231 0.539 . . . . 61.350000000000001 111.381 -177.072 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -89.88 -7.54 53.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.616 -0.72 . . . . 72.019999999999996 110.871 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 500' ' ' LYS . . . . . 0.414 ' CG ' ' HB2' ' A' ' 516' ' ' GLU . 3.4 mtmm -114.4 -48.75 2.86 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.048 -0.524 . . . . 64.439999999999998 112.054 -173.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.544 ' HB2' HG21 ' A' ' 498' ' ' THR . 57.2 m-85 -93.04 126.77 38.29 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.813 -0.44 . . . . 72.430000000000007 109.813 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 502' ' ' ARG . . . . . 0.466 ' HD2' ' HA ' ' A' ' 502' ' ' ARG . 1.2 tpt180 -117.09 123.11 45.99 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.234 -0.654 . . . . 63.240000000000002 109.234 177.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -104.13 117.46 34.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.236 -0.438 . . . . 64.5 110.228 -174.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 57.2 mttm -114.35 131.56 56.51 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.35 -0.386 . . . . 54.020000000000003 110.576 -178.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -103.9 118.27 36.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.196 -0.456 . . . . 73.140000000000001 110.687 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -120.42 89.92 3.22 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.104 -0.498 . . . . 62.450000000000003 110.016 174.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 61.68 -101.45 0.35 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.637 -0.71 . . . . 74.519999999999996 112.518 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.512 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 26.5 mt-30 -98.88 -20.23 16.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.524 0.202 . . . . 74.519999999999996 111.376 -177.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.637 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 14.7 ptt180 -101.04 153.54 19.46 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.333 0.587 . . . . 73.450000000000003 111.585 -175.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -121.99 141.37 51.41 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.424 -0.807 . . . . 75.530000000000001 109.494 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 511' ' ' HIS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 15.3 m-70 -110.6 133.26 53.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 110.02 -0.363 . . . . 64.019999999999996 110.02 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 66.6 tp -107.51 104.19 13.69 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.739 -0.467 . . . . 64.319999999999993 109.739 172.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.483 HD13 ' HD2' ' A' ' 504' ' ' LYS . 1.9 mp -100.91 127.7 53.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.065 -0.516 . . . . 53.329999999999998 110.092 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.579 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 53.7 mt -108.1 112.37 39.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.743 -0.466 . . . . 73.329999999999998 109.743 174.709 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -72.44 -44.45 62.37 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.195 -0.457 . . . . 45.43 111.144 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 516' ' ' GLU . . . . . 0.414 ' HB2' ' CG ' ' A' ' 500' ' ' LYS . 31.8 mt-10 -116.2 107.52 14.99 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.591 -0.522 . . . . 60.329999999999998 109.591 -178.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -94.2 113.21 25.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.383 -0.371 . . . . 61.450000000000003 110.47 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 518' ' ' MET . . . . . 0.453 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 25.0 mmt -110.7 164.8 12.39 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.166 -0.47 . . . . 62.439999999999998 110.281 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.541 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.1 mm? -61.37 -55.41 31.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 72.049999999999997 111.529 -172.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -82.99 -8.04 59.6 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.104 -0.498 . . . . 74.239999999999995 111.528 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 521' ' ' ASP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 9.2 t70 -82.28 -27.26 32.48 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.312 -0.404 . . . . 70.109999999999999 110.521 -175.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.677 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -63.27 -41.73 99.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 73.400000000000006 111.614 -177.1 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 523' ' ' GLY . . . . . 0.481 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 42.48 -158.2 0.07 OUTLIER Glycine 0 CA--C 1.526 0.742 0 O-C-N 123.783 0.677 . . . . 51.299999999999997 114.422 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -109.6 115.69 30.36 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.007 -0.738 . . . . 65.140000000000001 109.007 172.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -89.48 131.67 35.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.349 0.595 . . . . 73.349999999999994 111.145 -176.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.94 125.48 33.55 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.434 -0.803 . . . . 71.530000000000001 110.186 178.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.559 HD11 ' HB ' ' A' ' 484' ' ' VAL . 44.6 tp -92.55 112.32 24.23 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.478 -0.564 . . . . 51.329999999999998 109.478 177.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 528' ' ' CYS . . . . . 0.441 ' SG ' HD13 ' A' ' 487' ' ' LEU . 62.2 m -107.42 114.89 29.2 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.882 -0.599 . . . . 74.019999999999996 110.321 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.571 ' C ' ' H ' ' A' ' 531' ' ' GLY . 72.2 p -109.89 -165.39 1.0 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.054 -0.521 . . . . 73.230000000000004 109.874 178.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 530' ' ' SER . . . . . 0.464 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 20.3 m -48.6 6.65 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.742 1.217 . . . . 64.25 114.18 171.405 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 531' ' ' GLY . . . . . 0.571 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.44 26.62 1.95 Allowed Glycine 0 N--CA 1.451 -0.356 0 O-C-N 122.092 -0.38 . . . . 63.200000000000003 112.949 -176.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -110.45 144.38 17.08 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 109.406 -1.477 . . . . 64.239999999999995 109.406 163.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.58 132.39 48.21 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 117.83 0.815 . . . . 73.150000000000006 111.613 -171.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -141.12 128.59 21.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.697 -0.683 . . . . 62.350000000000001 109.451 172.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.425 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.7 tm? -114.8 131.95 56.64 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 110.101 -0.333 . . . . 62.549999999999997 110.101 -174.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.799 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -128.95 158.17 39.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.53 -0.305 . . . . 71.040000000000006 110.583 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -131.9 117.49 18.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.533 -0.303 . . . . 54.43 110.19 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.513 HD11 HG22 ' A' ' 465' ' ' VAL . 37.3 tp -106.1 128.71 54.07 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.979 -0.555 . . . . 74.200000000000003 109.831 178.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.653 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.3 mp -117.89 108.7 25.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 109.365 -0.605 . . . . 64.430000000000007 109.365 177.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.677 HG23 ' HB2' ' A' ' 522' ' ' ALA . 66.9 t -90.64 132.37 35.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.784 -0.45 . . . . 51.439999999999998 109.784 178.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -120.89 157.9 28.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.815 -0.63 . . . . 73.230000000000004 110.333 -175.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 542' ' ' GLU . . . . . 0.541 ' HG3' HD11 ' A' ' 519' ' ' LEU . 39.0 mt-10 -107.9 117.77 35.0 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.967 -0.561 . . . . 64.319999999999993 110.38 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 543' ' ' LYS . . . . . 0.877 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 9.6 mmpt? . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.31 -0.852 . . . . 52.43 109.58 171.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.629 0 N-CA-C 111.944 -0.463 . . . . 70.049999999999997 111.944 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 26.3 t -98.68 142.45 30.23 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 110.35 -0.241 . . . . 72.439999999999998 110.35 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -102.64 -35.91 8.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.098 0.475 . . . . 71.510000000000005 110.341 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 51.3 ttp -94.86 109.66 45.28 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.358 -0.837 . . . . 50.109999999999999 110.177 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -72.3 132.75 19.84 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 121.883 1.722 . . . . 71.230000000000004 111.136 177.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.476 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 83.0 t -67.08 111.51 2.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.064 0.459 . . . . 71.099999999999994 110.065 178.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 60.1 tp -91.22 148.63 22.22 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.498 -0.773 . . . . 62.399999999999999 110.344 -176.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.541 HD13 HD23 ' A' ' 527' ' ' LEU . 25.2 mt -94.79 99.52 9.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.232 -0.655 . . . . 65.299999999999997 109.232 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 12.5 p -70.02 -34.51 73.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.006 -0.543 . . . . 73.329999999999998 110.904 -176.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 458' ' ' ARG . 3.1 tpp180 -116.77 105.52 49.6 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 116.03 -0.532 . . . . 72.239999999999995 109.937 174.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -66.55 168.86 15.45 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.193 2.595 . . . . 74.120000000000005 111.254 175.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.67 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 2.5 mm? -65.0 153.59 40.22 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.811 -0.44 . . . . 62.299999999999997 109.811 -178.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 461' ' ' GLU . . . . . 0.434 ' HB3' HE22 ' A' ' 463' ' ' GLN . 2.6 tp10 -66.37 152.99 43.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.412 0.625 . . . . 71.439999999999998 111.652 -170.044 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -92.02 9.01 35.03 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.816 1.043 . . . . 73.310000000000002 113.816 -167.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 463' ' ' GLN . . . . . 0.434 HE22 ' HB3' ' A' ' 461' ' ' GLU . 0.0 OUTLIER -123.13 153.86 39.41 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.572 -0.851 . . . . 75.219999999999999 112.109 -166.37 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.72 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.3 pt? -118.02 144.9 45.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.291 -1.322 . . . . 62.130000000000003 110.798 -170.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.401 HG11 ' HB ' ' A' ' 471' ' ' VAL . 31.2 m -117.71 177.64 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.225 0.536 . . . . 61.520000000000003 112.131 -174.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.81 171.12 9.07 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.543 -0.753 . . . . 50.509999999999998 110.707 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 467' ' ' VAL . . . . . 0.553 HG21 ' HG2' ' A' ' 542' ' ' GLU . 46.8 t -59.67 125.81 16.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.211 -0.449 . . . . 51.109999999999999 111.32 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 81.96 3.4 90.59 Favored Glycine 0 CA--C 1.517 0.201 0 CA-C-N 115.889 -0.596 . . . . 63.100000000000001 113.065 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -96.01 136.99 35.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.752 0.311 . . . . 74.140000000000001 110.608 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 470' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 1.5 ptm180 -66.84 146.69 54.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.824 -0.625 . . . . 74.319999999999993 111.377 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.401 ' HB ' HG11 ' A' ' 465' ' ' VAL . 7.7 p -147.38 137.94 17.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.579 -0.737 . . . . 72.219999999999999 109.643 175.447 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.52 ' HG3' HG13 ' A' ' 513' ' ' ILE . 13.0 mp0 -107.68 130.96 54.88 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.871 0.367 . . . . 63.32 110.559 178.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.588 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 57.8 m-85 -108.07 113.21 26.2 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.574 -0.528 . . . . 72.329999999999998 109.574 170.063 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -95.81 132.45 41.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.649 -0.705 . . . . 62.200000000000003 110.388 -176.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 458' ' ' ARG . 7.0 p -141.29 118.54 11.38 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.875 0.369 . . . . 73.200000000000003 110.613 177.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.993 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 23.4 mt-10 -112.16 138.24 49.12 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.527 -0.545 . . . . 62.439999999999998 109.527 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.492 HG21 ' HB3' ' A' ' 482' ' ' ALA . 26.2 m -122.6 173.12 8.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.578 -0.283 . . . . 64.400000000000006 111.304 -178.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 15.4 m -61.61 -36.27 80.26 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.152 0.797 . . . . 41.340000000000003 113.152 -175.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -119.72 156.25 30.89 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.421 -0.215 . . . . 72.099999999999994 110.421 -172.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 480' ' ' GLU . . . . . 0.483 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 0.1 OUTLIER -86.34 143.72 27.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.095 0.474 . . . . 62.43 110.563 -179.005 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 72.62 3.38 58.57 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.821 -0.704 . . . . 71.329999999999998 112.733 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.492 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -56.07 134.38 52.59 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.845 0.355 . . . . 73.430000000000007 110.959 -179.048 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -78.09 139.3 39.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.748 -0.66 . . . . 44.130000000000003 110.058 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.6 ' HB ' HD11 ' A' ' 527' ' ' LEU . 20.1 m -127.44 150.58 33.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.049 0.452 . . . . 72.299999999999997 110.875 -178.45 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 485' ' ' LYS . . . . . 0.552 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 65.4 tttp -108.2 122.09 46.2 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.608 -0.724 . . . . 73.319999999999993 109.378 179.342 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 486' ' ' TRP . . . . . 0.54 ' HB3' HD12 ' A' ' 493' ' ' LEU . 59.1 m95 -101.34 122.22 43.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.945 0.403 . . . . 75.319999999999993 110.623 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 487' ' ' LEU . . . . . 0.456 HD11 ' HE3' ' A' ' 485' ' ' LYS . 86.0 mt -130.15 139.08 50.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.865 -0.607 . . . . 63.039999999999999 111.34 -176.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.628 ' O ' HG12 ' A' ' 491' ' ' VAL . 3.7 tmmm? -115.3 106.52 14.13 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.085 -1.08 . . . . 73.310000000000002 108.085 168.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 51.79 34.37 13.06 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.162 -0.472 . . . . 63.030000000000001 111.253 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.42 -14.57 60.78 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.807 -0.711 . . . . 44.32 114.015 175.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 491' ' ' VAL . . . . . 0.628 HG12 ' O ' ' A' ' 488' ' ' LYS . 6.2 p -87.89 139.72 16.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-N 117.862 0.831 . . . . 51.030000000000001 110.559 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -66.59 124.18 22.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.986 -0.552 . . . . 75.200000000000003 111.567 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.54 HD12 ' HB3' ' A' ' 486' ' ' TRP . 94.1 mt -84.15 106.81 16.08 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.921 -0.77 . . . . 73.349999999999994 108.921 171.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 5.5 t -64.39 129.09 38.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.331 0.586 . . . . 74.430000000000007 111.656 -174.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.16 3.01 18.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.587 -0.733 . . . . 73.129999999999995 110.455 176.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -59.6 -54.27 48.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.099 -0.5 . . . . 72.019999999999996 109.954 173.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -149.34 111.62 4.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.609 -0.723 . . . . 53.450000000000003 109.833 174.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.448 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.2 OUTLIER -124.6 125.83 44.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.061 -0.518 . . . . 71.299999999999997 110.229 -178.119 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -94.81 -42.08 8.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.452 0.644 . . . . 73.400000000000006 110.17 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -80.17 -44.25 20.17 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.318 -0.856 . . . . 65.129999999999995 110.895 -173.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.448 ' O ' ' HB ' ' A' ' 498' ' ' THR . 5.1 m-85 -104.95 141.82 35.88 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.027 -0.731 . . . . 73.329999999999998 109.027 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 21.0 mtp180 -128.26 123.22 33.59 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.111 0.481 . . . . 65.420000000000002 109.742 176.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -94.77 127.8 41.03 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.634 -0.712 . . . . 74.319999999999993 110.368 -174.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.621 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 1.3 mptm? -114.4 144.85 42.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.421 -0.354 . . . . 54.340000000000003 110.679 177.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -116.24 130.35 56.74 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.051 -0.522 . . . . 65.409999999999997 109.823 177.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 506' ' ' ASP . . . . . 0.403 ' HB3' ' HG3' ' A' ' 509' ' ' ARG . 27.7 t70 -138.83 86.83 2.17 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.136 0.493 . . . . 75.200000000000003 110.06 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 63.7 -104.28 0.83 Allowed Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.899 -0.591 . . . . 52.109999999999999 112.551 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.483 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 21.6 mt-30 -95.43 -15.36 23.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.865 0.365 . . . . 73.510000000000005 110.797 -176.458 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.993 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 5.7 ptt180 -106.93 139.58 41.1 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.507 0.67 . . . . 73.25 111.786 -175.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -114.5 143.85 44.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.179 -0.919 . . . . 72.230000000000004 108.71 176.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 511' ' ' HIS . . . . . 0.621 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 84.6 m-70 -118.14 128.0 54.31 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.339 -0.245 . . . . 74.239999999999995 110.339 -177.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.588 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 57.7 tp -104.16 103.86 13.7 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.793 -0.447 . . . . 73.319999999999993 109.793 174.06 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.52 HG13 ' HG3' ' A' ' 472' ' ' GLU . 1.7 mp -98.23 118.93 45.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.025 -0.534 . . . . 74.230000000000004 110.217 177.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.48 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 62.2 mt -100.17 113.2 34.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.813 -0.63 . . . . 62.140000000000001 109.659 175.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -75.47 -46.98 29.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.102 0.477 . . . . 71.510000000000005 110.611 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -121.17 108.33 13.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.727 -0.67 . . . . 71.140000000000001 109.629 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.448 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -91.37 117.34 29.58 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.156 -0.475 . . . . 72.420000000000002 110.302 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 25.7 mmt -108.14 166.85 10.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.448 -0.342 . . . . 63.32 110.548 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.446 HD22 ' H ' ' A' ' 519' ' ' LEU . 3.3 mm? -57.73 -53.32 59.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 45.299999999999997 111.214 -174.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -77.69 -18.04 57.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.818 -0.628 . . . . 60.530000000000001 110.975 -175.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -80.17 -21.02 43.49 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.106 -0.497 . . . . 71.109999999999999 111.831 -174.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.664 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -63.36 -42.85 98.91 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.966 -0.293 . . . . 55.420000000000002 110.892 -177.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.23 -158.66 0.06 OUTLIER Glycine 0 C--N 1.335 0.498 0 CA-C-N 115.282 -0.872 . . . . 42.310000000000002 114.02 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 -118.98 108.64 15.0 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.087 -0.709 . . . . 75.409999999999997 109.087 170.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 525' ' ' TYR . . . . . 0.477 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 16.1 m-30 -85.19 132.81 34.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.084 -0.507 . . . . 74.5 111.186 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -134.89 119.25 17.84 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.539 -0.755 . . . . 64.409999999999997 109.641 176.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.6 HD11 ' HB ' ' A' ' 484' ' ' VAL . 40.9 tp -89.02 117.95 28.4 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.244 -0.434 . . . . 73.409999999999997 110.171 -177.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 528' ' ' CYS . . . . . 0.552 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 70.0 m -104.45 122.88 46.45 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.975 -0.557 . . . . 72.400000000000006 109.976 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.555 HG23 HG12 ' A' ' 484' ' ' VAL . 0.2 OUTLIER -116.54 -167.08 1.23 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.889 -0.596 . . . . 74.319999999999993 110.275 -175.724 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 530' ' ' SER . . . . . 0.454 ' H ' HG22 ' A' ' 529' ' ' THR . 9.9 m -52.11 7.4 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.418 1.487 . . . . 60.100000000000001 114.082 173.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 531' ' ' GLY . . . . . 0.546 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.14 26.73 1.99 Allowed Glycine 0 N--CA 1.452 -0.293 0 N-CA-C 111.69 -0.564 . . . . 73.120000000000005 111.69 -168.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -123.75 142.29 14.17 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 109.168 -1.573 . . . . 71.439999999999998 109.168 165.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.29 121.36 20.03 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 117.701 0.751 . . . . 73.209999999999994 110.694 -173.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -118.28 139.08 51.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.174 -0.466 . . . . 44.25 110.745 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.411 HD13 ' N ' ' A' ' 536' ' ' ALA . 3.0 tm? -106.61 134.96 48.96 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.568 -0.53 . . . . 72.310000000000002 109.568 -177.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.67 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -118.47 152.58 35.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.771 0.32 . . . . 55.509999999999998 111.242 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -117.19 116.18 26.77 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.119 -0.492 . . . . 74.319999999999993 109.901 175.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.548 HD23 ' HA ' ' A' ' 522' ' ' ALA . 28.1 tp -129.82 115.9 17.92 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.989 0.424 . . . . 64.109999999999999 109.878 175.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.479 ' HB ' ' CD1' ' A' ' 464' ' ' LEU . 62.0 mt -126.95 109.05 19.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.333 -0.617 . . . . 73.209999999999994 109.333 176.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.664 HG23 ' HB2' ' A' ' 522' ' ' ALA . 79.2 t -89.67 127.83 42.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 N-CA-C 109.284 -0.636 . . . . 50.340000000000003 109.284 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -126.65 144.3 50.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.848 -0.615 . . . . 61.140000000000001 110.855 -174.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 542' ' ' GLU . . . . . 0.553 ' HG2' HG21 ' A' ' 467' ' ' VAL . 37.7 mt-10 -89.2 109.95 20.76 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.115 -0.698 . . . . 71.450000000000003 109.115 173.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 58.1 pttt . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.539 -0.743 . . . . 73.019999999999996 109.961 -178.433 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.754 0 N-CA-C 112.479 -0.248 . . . . 64.450000000000003 112.479 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 48.9 m 64.96 19.83 11.95 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 122.835 0.454 . . . . 71.239999999999995 111.606 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 3.2 t-160 -92.62 83.28 4.86 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.447 -0.946 . . . . 60.149999999999999 108.447 177.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 23.8 ptm -98.69 138.93 20.79 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 116.122 -0.49 . . . . 64.519999999999996 111.378 -172.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -81.22 131.93 7.96 Favored 'Trans proline' 0 N--CA 1.448 -1.165 0 C-N-CA 122.343 2.029 . . . . 54.039999999999999 110.214 169.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.55 ' H ' ' HB2' ' A' ' 530' ' ' SER . 98.2 t -74.86 110.27 9.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.817 -0.438 . . . . 71.349999999999994 109.817 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 60.4 tp -79.49 129.95 34.95 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.624 -0.716 . . . . 63.439999999999998 110.151 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.501 HD13 HD23 ' A' ' 527' ' ' LEU . 42.3 mt -80.27 98.23 3.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.884 -0.784 . . . . 70.019999999999996 108.884 175.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 35.7 p -69.62 -39.45 77.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.627 -0.715 . . . . 64.0 111.382 -172.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.676 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 6.4 tpt180 -102.81 122.46 45.75 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.843 -0.617 . . . . 74.010000000000005 110.5 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.43 165.72 23.98 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.87 2.38 . . . . 73.349999999999994 112.294 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.542 ' CB ' ' HB2' ' A' ' 536' ' ' ALA . 4.1 mm? -80.26 172.01 14.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.129 -0.487 . . . . 74.409999999999997 111.408 -179.008 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 461' ' ' GLU . . . . . 0.557 ' HG3' ' OE1' ' A' ' 463' ' ' GLN . 0.3 OUTLIER -69.3 138.31 53.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.495 -0.775 . . . . 72.530000000000001 111.561 -175.64 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -104.97 8.56 34.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.983 -1.008 . . . . 70.340000000000003 113.321 -169.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 463' ' ' GLN . . . . . 0.557 ' OE1' ' HG3' ' A' ' 461' ' ' GLU . 0.2 OUTLIER -124.07 152.73 42.34 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 119.54 -0.864 . . . . 72.109999999999999 112.151 -168.709 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.585 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.3 pt? -100.4 146.43 27.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.495 -1.23 . . . . 73.519999999999996 111.433 -171.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.527 HG11 ' HB ' ' A' ' 471' ' ' VAL . 27.1 m -117.82 177.09 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.04 0.447 . . . . 71.340000000000003 110.508 175.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 466' ' ' MET . . . . . 0.405 ' HG2' ' HG3' ' A' ' 543' ' ' LYS . 37.7 mtm -118.18 159.77 22.73 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.001 -0.545 . . . . 74.549999999999997 110.135 -177.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 467' ' ' VAL . . . . . 0.512 HG21 ' HG2' ' A' ' 542' ' ' GLU . 64.8 t -55.27 124.33 8.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.004 0.43 . . . . 72.409999999999997 111.495 -174.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.41 -11.96 58.31 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.975 -0.631 . . . . 54.439999999999998 112.616 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -102.98 145.3 30.08 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.102 -0.333 . . . . 73.120000000000005 110.102 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 470' ' ' ARG . . . . . 0.504 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 5.4 ptp180 -86.76 135.1 33.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.268 0.556 . . . . 73.239999999999995 111.649 -177.082 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.527 ' HB ' HG11 ' A' ' 465' ' ' VAL . 7.1 p -119.1 133.96 64.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.622 -0.717 . . . . 54.229999999999997 110.019 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -115.44 127.9 55.66 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.507 -0.315 . . . . 64.109999999999999 110.176 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.46 ' HB3' HD12 ' A' ' 460' ' ' LEU . 96.5 m-85 -104.77 115.65 30.67 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.479 -0.563 . . . . 74.140000000000001 109.479 177.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.42 133.96 47.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.234 -0.439 . . . . 62.329999999999998 110.046 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 509' ' ' ARG . 20.9 p -149.41 147.56 28.42 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.194 -0.457 . . . . 73.340000000000003 110.681 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.676 ' HB2' ' HB3' ' A' ' 458' ' ' ARG . 49.1 mt-10 -123.07 138.75 54.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.839 0.352 . . . . 61.350000000000001 110.286 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.401 ' O ' ' HB3' ' A' ' 508' ' ' GLN . 18.6 m -113.11 163.3 10.44 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.928 -0.578 . . . . 74.239999999999995 109.742 174.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 11.5 t -60.67 -38.35 84.63 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.162 0.43 . . . . 45.130000000000003 112.162 -175.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 479' ' ' GLU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 6.6 tp10 -106.98 139.71 40.94 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.255 -0.276 . . . . 71.540000000000006 110.255 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.51 134.98 43.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.261 0.553 . . . . 73.120000000000005 111.157 -177.042 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 63.46 19.74 62.66 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.749 -0.66 . . . . 70.329999999999998 112.862 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.553 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -62.1 151.56 35.3 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.93 0.395 . . . . 74.209999999999994 111.077 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 483' ' ' GLN . . . . . 0.482 ' CD ' ' H ' ' A' ' 483' ' ' GLN . 3.4 pm0 -72.54 118.89 16.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.451 0.643 . . . . 75.140000000000001 110.912 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.634 HG12 HG23 ' A' ' 529' ' ' THR . 34.9 m -127.34 150.66 33.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.299 -0.864 . . . . 62.119999999999997 109.508 178.012 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 485' ' ' LYS . . . . . 0.562 ' HE2' ' HG3' ' A' ' 492' ' ' GLU . 83.6 tttt -128.31 136.33 50.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.768 0.318 . . . . 72.120000000000005 110.18 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 486' ' ' TRP . . . . . 0.563 ' HB3' HD12 ' A' ' 493' ' ' LEU . 90.1 m95 -102.15 125.92 48.97 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.971 0.415 . . . . 72.120000000000005 110.814 -176.813 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 487' ' ' LEU . . . . . 0.533 ' HG ' ' HA ' ' A' ' 492' ' ' GLU . 8.0 mp -126.32 159.53 32.88 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.926 -0.579 . . . . 61.409999999999997 110.068 176.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -141.15 116.97 10.39 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.448 -0.575 . . . . 74.329999999999998 109.448 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 57.82 34.14 24.04 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.511 0.507 . . . . 65.239999999999995 110.614 -175.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 81.98 -10.71 51.67 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.683 -0.689 . . . . 74.0 112.449 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 40.6 t -86.78 129.98 37.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.869 -0.419 . . . . 74.040000000000006 109.869 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 492' ' ' GLU . . . . . 0.562 ' HG3' ' HE2' ' A' ' 485' ' ' LYS . 33.1 tt0 -65.27 131.07 45.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.67 . . . . 65.430000000000007 110.259 -179.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.563 HD12 ' HB3' ' A' ' 486' ' ' TRP . 85.6 mt -85.54 118.24 24.93 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.945 -0.391 . . . . 71.219999999999999 109.945 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 5.1 t -67.18 145.85 54.82 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.571 -0.741 . . . . 75.099999999999994 111.161 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 495' ' ' ARG . . . . . 0.479 ' HD3' ' H ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -120.44 16.09 12.12 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.14 -0.689 . . . . 75.420000000000002 109.14 175.047 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -76.98 -60.97 2.14 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.231 -0.895 . . . . 64.430000000000007 109.578 176.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 497' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 497' ' ' GLU . 0.8 OUTLIER -105.31 106.56 17.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.286 0.565 . . . . 74.239999999999995 109.899 174.595 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.487 HG21 ' HE1' ' A' ' 503' ' ' PHE . 2.8 p -136.73 87.62 2.3 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.392 0.615 . . . . 73.030000000000001 111.505 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -105.8 -26.69 11.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.597 -0.729 . . . . 63.100000000000001 109.339 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 500' ' ' LYS . . . . . 0.429 ' HE3' ' CE2' ' A' ' 501' ' ' TYR . 42.2 pttt -94.51 -22.83 17.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.262 -0.881 . . . . 71.519999999999996 110.831 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.478 ' O ' ' HB ' ' A' ' 498' ' ' THR . 6.6 m-85 -118.88 133.67 55.68 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.703 -0.48 . . . . 54.119999999999997 109.703 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 502' ' ' ARG . . . . . 0.619 ' HB2' ' CG2' ' A' ' 513' ' ' ILE . 33.7 mmt180 -122.99 126.79 47.83 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.902 -0.407 . . . . 74.439999999999998 109.902 176.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 503' ' ' PHE . . . . . 0.487 ' HE1' HG21 ' A' ' 498' ' ' THR . 88.7 m-85 -94.98 113.26 24.95 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.063 -0.347 . . . . 74.25 110.063 178.636 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.647 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 4.7 mptp? -102.08 119.89 39.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.608 -0.269 . . . . 72.319999999999993 111.047 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -102.62 111.91 24.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.261 -0.644 . . . . 53.43 109.261 173.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 506' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 509' ' ' ARG . 33.1 t70 -136.28 74.6 1.51 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.299 0.571 . . . . 74.25 110.137 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 82.58 -131.71 10.58 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.804 -0.712 . . . . 51.299999999999997 112.055 -178.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.401 ' HB3' ' O ' ' A' ' 477' ' ' VAL . 20.3 mt-30 -79.23 -23.63 43.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.066 0.46 . . . . 52.399999999999999 110.397 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 506' ' ' ASP . 18.4 ptt180 -89.48 143.32 26.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.501 -0.772 . . . . 73.109999999999999 110.805 -177.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 -130.26 118.96 22.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.826 -0.624 . . . . 61.020000000000003 109.492 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 511' ' ' HIS . . . . . 0.647 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 13.5 m-70 -101.87 122.84 44.76 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.993 -0.283 . . . . 71.400000000000006 110.349 -176.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 67.8 tp -105.75 108.51 20.06 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.556 -0.535 . . . . 73.540000000000006 109.556 172.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.619 ' CG2' ' HB2' ' A' ' 502' ' ' ARG . 9.8 tp -99.47 124.72 52.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.323 0.582 . . . . 74.109999999999999 110.328 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 74.5 mt -104.29 111.7 34.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 108.93 -0.767 . . . . 72.409999999999997 108.93 173.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -72.92 -44.04 61.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.132 0.491 . . . . 73.230000000000004 110.829 -176.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -131.24 108.85 9.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.815 -0.629 . . . . 75.5 109.885 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.428 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -90.52 131.37 36.3 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.191 -0.459 . . . . 73.219999999999999 110.768 -178.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 518' ' ' MET . . . . . 0.527 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 10.1 mmt -95.69 167.25 11.4 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.225 -0.443 . . . . 74.010000000000005 110.502 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.485 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.7 mm? -62.39 -53.73 50.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.88 0.371 . . . . 74.430000000000007 111.593 -176.203 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -81.57 -12.15 58.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.114 0.483 . . . . 74.349999999999994 110.669 -177.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 521' ' ' ASP . . . . . 0.527 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 29.1 t70 -74.93 -16.41 60.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.713 -0.676 . . . . 74.0 111.057 -175.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.567 ' HB1' ' O ' ' A' ' 538' ' ' LEU . . . -61.42 -41.77 97.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.644 -0.253 . . . . 43.130000000000003 110.409 -178.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 40.0 -157.23 0.03 OUTLIER Glycine 0 CA--C 1.522 0.53 0 N-CA-C 116.0 1.16 . . . . 72.5 116.0 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -118.49 107.24 13.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.57 -0.815 . . . . 63.509999999999998 109.056 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 525' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' A' ' 493' ' ' LEU . 29.0 m-85 -85.94 133.55 33.93 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.069 0.461 . . . . 64.329999999999998 111.283 -176.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -135.56 137.75 42.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.769 -0.65 . . . . 72.030000000000001 110.558 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.568 HD11 ' HB ' ' A' ' 484' ' ' VAL . 42.1 tp -102.87 110.09 21.89 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.054 -0.521 . . . . 60.340000000000003 110.172 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 528' ' ' CYS . . . . . 0.416 ' SG ' HD13 ' A' ' 487' ' ' LEU . 94.6 m -90.76 117.09 29.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.147 -0.478 . . . . 62.32 110.189 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.634 HG23 HG12 ' A' ' 484' ' ' VAL . 0.2 OUTLIER -115.82 -169.86 1.67 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.88 -0.6 . . . . 43.229999999999997 110.275 -177.711 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 530' ' ' SER . . . . . 0.55 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 17.3 m -55.57 8.96 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.12 1.368 . . . . 74.219999999999999 113.772 173.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 531' ' ' GLY . . . . . 0.513 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.76 26.88 2.03 Favored Glycine 0 N--CA 1.45 -0.405 0 CA-C-O 121.515 0.508 . . . . 42.210000000000001 111.942 -170.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -115.04 144.47 18.45 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 109.608 -1.397 . . . . 61.140000000000001 109.608 165.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -132.7 120.74 22.1 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 117.586 0.693 . . . . 72.439999999999998 111.405 -174.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -127.44 147.1 50.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.658 -0.701 . . . . 74.010000000000005 109.658 173.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.506 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.0 tm? -123.43 137.76 54.74 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.879 -0.415 . . . . 44.109999999999999 109.879 -176.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.542 ' HB2' ' CB ' ' A' ' 460' ' ' LEU . . . -132.51 141.05 48.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.439 -0.346 . . . . 71.409999999999997 110.324 177.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -121.47 117.21 26.28 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.233 0.539 . . . . 63.299999999999997 110.978 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.567 ' O ' ' HB1' ' A' ' 522' ' ' ALA . 46.9 tp -102.01 140.47 36.25 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.284 -0.871 . . . . 73.409999999999997 109.162 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.585 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 5.0 mp -125.28 108.62 20.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.536 -0.542 . . . . 41.509999999999998 109.536 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.453 HG23 ' HB2' ' A' ' 522' ' ' ALA . 66.7 t -107.13 129.3 61.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.921 0.391 . . . . 74.209999999999994 110.647 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -129.51 150.95 50.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.833 -0.622 . . . . 63.119999999999997 109.529 178.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 542' ' ' GLU . . . . . 0.512 ' HG2' HG21 ' A' ' 467' ' ' VAL . 34.3 mt-10 -73.93 108.75 6.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.059 0.457 . . . . 73.019999999999996 110.407 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 543' ' ' LYS . . . . . 0.405 ' HG3' ' HG2' ' A' ' 466' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 N-CA-C 108.889 -0.782 . . . . 72.450000000000003 108.889 179.097 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 N-CA-C 111.999 -0.44 . . . . 71.109999999999999 111.999 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 22.2 m -64.36 132.81 51.19 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 120.885 0.374 . . . . 72.349999999999994 110.331 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -88.36 74.77 8.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.33 0.586 . . . . 73.030000000000001 110.702 -178.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 55.8 ttp -96.56 104.63 18.59 Favored Pre-proline 0 C--N 1.321 -0.647 0 N-CA-C 108.691 -0.855 . . . . 73.200000000000003 108.691 173.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -69.56 131.42 21.49 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.678 1.585 . . . . 65.219999999999999 111.205 -177.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.455 ' H ' ' HB2' ' A' ' 530' ' ' SER . 94.7 t -76.2 107.69 7.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 109.485 -0.561 . . . . 75.200000000000003 109.485 178.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 54.6 tp -98.43 133.42 42.84 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.67 -0.695 . . . . 70.519999999999996 110.142 -176.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 54.2 mt -74.04 102.84 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 109.242 -0.651 . . . . 74.430000000000007 109.242 178.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.25 -13.19 57.42 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.415 -0.812 . . . . 42.530000000000001 110.657 -173.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.478 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 18.8 tpp180 -137.95 112.04 8.82 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 116.001 -0.545 . . . . 63.229999999999997 109.764 175.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -57.19 166.2 4.57 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.786 2.324 . . . . 70.030000000000001 111.669 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.691 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 1.7 mm? -74.3 171.75 13.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.385 -0.371 . . . . 71.340000000000003 110.474 -175.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -66.67 148.25 52.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.868 -0.606 . . . . 73.409999999999997 111.805 -171.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -105.35 9.94 33.63 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.768 1.025 . . . . 73.219999999999999 113.768 -169.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.92 153.18 38.81 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 119.063 -1.055 . . . . 75.349999999999994 112.592 -165.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.575 ' H ' HD23 ' A' ' 464' ' ' LEU . 1.9 pt? -94.18 146.9 23.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.008 -1.451 . . . . 73.409999999999997 111.353 -173.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.617 HG23 HG22 ' A' ' 540' ' ' VAL . 29.7 m -128.34 177.2 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 73.099999999999994 111.682 -175.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -109.31 165.82 11.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 75.049999999999997 110.276 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 467' ' ' VAL . . . . . 0.435 HG12 ' HA ' ' A' ' 518' ' ' MET . 13.9 m -68.08 139.56 20.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.003 0.43 . . . . 62.549999999999997 111.263 177.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 78.61 4.03 87.31 Favored Glycine 0 CA--C 1.518 0.268 0 CA-C-N 115.899 -0.591 . . . . 62.350000000000001 113.452 175.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 60.0 tt0 -108.21 143.85 36.46 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.848 -0.427 . . . . 52.229999999999997 109.848 178.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 470' ' ' ARG . . . . . 0.6 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 0.0 OUTLIER -66.42 140.4 58.05 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.18 0.514 . . . . 62.450000000000003 110.997 -179.134 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.475 HG22 HG21 ' A' ' 465' ' ' VAL . 4.6 t -114.52 133.37 60.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.712 -0.676 . . . . 61.039999999999999 109.654 177.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -112.37 119.47 38.37 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.054 0.454 . . . . 75.040000000000006 110.467 178.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.493 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 36.6 m-85 -109.46 130.58 55.49 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.524 -0.762 . . . . 63.5 110.635 174.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -109.65 140.55 43.35 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.016 -0.538 . . . . 72.0 110.149 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.639 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 21.9 p -149.47 125.46 10.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.788 0.328 . . . . 63.210000000000001 110.872 177.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.478 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 44.8 mt-10 -108.56 140.92 41.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.15 -0.477 . . . . 75.540000000000006 109.739 178.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.434 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 27.9 m -130.24 170.6 18.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.61 0.243 . . . . 75.530000000000001 110.658 176.261 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 12.5 p -70.6 -35.3 72.93 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.514 0.561 . . . . 51.219999999999999 112.514 -174.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 479' ' ' GLU . . . . . 0.572 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 39.6 tt0 -101.96 134.14 45.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.72 0.295 . . . . 72.200000000000003 110.93 -178.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 480' ' ' GLU . . . . . 0.607 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 14.0 pt-20 -79.23 132.26 36.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.954 0.407 . . . . 74.439999999999998 110.059 176.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 481' ' ' GLY . . . . . 0.556 ' HA2' ' HD2' ' A' ' 505' ' ' LYS . . . 75.93 12.01 84.28 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.783 -0.723 . . . . 23.350000000000001 112.437 -176.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.572 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -60.37 141.58 56.09 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.781 0.324 . . . . 74.310000000000002 111.477 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 483' ' ' GLN . . . . . 0.405 ' CD ' ' H ' ' A' ' 483' ' ' GLN . 5.1 pm0 -83.69 118.03 23.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.321 0.581 . . . . 72.230000000000004 110.558 -178.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 26.3 m -136.12 159.69 38.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.656 -0.702 . . . . 75.519999999999996 110.222 -178.074 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 66.0 pttt -136.0 152.94 51.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.806 0.336 . . . . 71.340000000000003 110.497 176.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -102.78 134.0 46.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.094 -0.503 . . . . 72.519999999999996 111.359 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 487' ' ' LEU . . . . . 0.557 HD13 ' SG ' ' A' ' 528' ' ' CYS . 10.7 mp -118.33 136.28 53.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.699 -0.682 . . . . 73.230000000000004 109.205 172.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.463 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 3.0 tmmm? -120.66 110.33 16.28 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.878 0.37 . . . . 72.219999999999999 110.077 -177.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.5 t70 58.04 35.66 25.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.182 -0.917 . . . . 74.319999999999993 110.591 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 92.79 -9.23 75.89 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.673 -0.694 . . . . 61.350000000000001 112.88 178.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 46.9 t -101.42 122.95 54.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 110.189 -0.3 . . . . 71.439999999999998 110.189 -179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' GLU . . . . . 0.542 ' HA ' ' HG ' ' A' ' 487' ' ' LEU . 36.0 tt0 -70.99 127.82 33.87 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.097 -0.501 . . . . 65.140000000000001 110.232 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.665 HD11 ' HE1' ' A' ' 525' ' ' TYR . 91.7 mt -77.53 119.82 21.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.269 -0.423 . . . . 74.5 110.24 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 15.0 t -71.64 144.51 49.39 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.184 0.516 . . . . 71.329999999999998 110.234 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 495' ' ' ARG . . . . . 0.496 ' HD3' ' N ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -113.98 10.3 17.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.052 -0.522 . . . . 73.230000000000004 109.983 -179.387 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -79.4 -36.2 39.49 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.112 -0.699 . . . . 54.420000000000002 109.112 175.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.77 133.79 47.2 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.809 -0.812 . . . . 74.329999999999998 108.809 172.131 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.519 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.3 OUTLIER -151.17 88.72 1.47 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.348 0.594 . . . . 62.25 111.164 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -101.92 -23.66 14.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.494 -0.775 . . . . 72.530000000000001 109.289 176.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -92.61 -22.63 19.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.505 -0.77 . . . . 55.329999999999998 110.406 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.519 ' O ' ' HB ' ' A' ' 498' ' ' THR . 27.7 m-85 -128.97 161.05 30.81 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.402 -0.363 . . . . 74.030000000000001 110.355 -176.179 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 502' ' ' ARG . . . . . 0.429 ' HD2' ' HA ' ' A' ' 502' ' ' ARG . 2.1 tpt180 -152.94 123.84 7.41 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.171 -0.678 . . . . 72.420000000000002 109.171 173.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -95.03 112.84 24.5 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.191 -0.459 . . . . 64.200000000000003 110.39 -176.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.93 124.48 48.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.973 0.416 . . . . 75.299999999999997 110.635 178.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.556 ' HD2' ' HA2' ' A' ' 481' ' ' GLY . 1.6 tppp? -91.5 126.38 36.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.706 -0.679 . . . . 75.230000000000004 109.577 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -148.12 84.3 1.51 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.327 0.584 . . . . 74.439999999999998 110.573 -176.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.4 -127.22 29.01 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.669 -0.696 . . . . 53.439999999999998 112.699 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 78.1 mt-30 -84.66 -3.65 58.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.562 0.22 . . . . 74.420000000000002 111.46 -178.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -118.09 153.88 33.02 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.493 0.663 . . . . 71.409999999999997 111.176 -177.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 510' ' ' HIS . . . . . 0.639 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 36.3 m-70 -124.88 126.21 45.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.416 -0.811 . . . . 74.019999999999996 109.17 -179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 64.8 m-70 -101.54 117.33 34.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.518 -0.549 . . . . 74.129999999999995 109.518 -177.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 55.4 tp -101.32 121.68 42.32 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.293 -0.412 . . . . 70.030000000000001 110.059 178.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 10.8 tp -106.39 130.3 58.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.729 -0.471 . . . . 73.329999999999998 109.729 176.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.6 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 54.6 mt -105.47 112.59 39.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.781 -0.822 . . . . 73.019999999999996 108.781 171.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -75.34 -48.49 22.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.956 -0.566 . . . . 64.420000000000002 110.646 -176.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -122.18 108.41 13.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.87 -0.605 . . . . 71.200000000000003 110.125 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -101.82 136.45 41.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.1 -0.5 . . . . 51.43 111.288 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 518' ' ' MET . . . . . 0.435 ' HA ' HG12 ' A' ' 467' ' ' VAL . 9.3 mmt -126.47 175.97 7.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.951 -0.568 . . . . 75.439999999999998 110.711 175.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.501 HD22 ' H ' ' A' ' 519' ' ' LEU . 2.9 mm? -61.49 -55.66 28.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.38 -0.373 . . . . 75.319999999999993 111.586 -171.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -84.14 -10.15 58.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.821 0.343 . . . . 75.420000000000002 111.376 -177.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -80.15 -13.0 59.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.128 -0.487 . . . . 44.32 109.876 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.601 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -70.73 -41.64 71.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.195 -0.457 . . . . 63.310000000000002 111.021 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.54 -158.25 0.07 OUTLIER Glycine 0 CA--C 1.523 0.583 0 N-CA-C 114.975 0.75 . . . . 63.039999999999999 114.975 176.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -117.22 110.9 18.71 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.271 -0.64 . . . . 72.450000000000003 109.271 174.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 525' ' ' TYR . . . . . 0.665 ' HE1' HD11 ' A' ' 493' ' ' LEU . 30.1 m-85 -85.03 131.72 34.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.489 0.662 . . . . 54.420000000000002 111.756 -174.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.78 126.74 25.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.958 -1.019 . . . . 63.539999999999999 109.699 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 47.4 tp -87.99 115.29 25.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.135 -0.484 . . . . 75.129999999999995 109.971 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 528' ' ' CYS . . . . . 0.557 ' SG ' HD13 ' A' ' 487' ' ' LEU . 76.3 m -94.61 113.08 24.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.133 0.492 . . . . 72.540000000000006 109.864 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.441 ' C ' ' H ' ' A' ' 531' ' ' GLY . 54.6 p -116.85 -166.78 1.2 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.573 -0.74 . . . . 61.530000000000001 111.401 -174.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 530' ' ' SER . . . . . 0.455 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 19.2 m -59.88 6.56 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.792 1.237 . . . . 71.450000000000003 113.234 174.082 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 531' ' ' GLY . . . . . 0.441 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.47 28.22 1.65 Allowed Glycine 0 C--O 1.228 -0.251 0 C-N-CA 120.992 -0.623 . . . . 74.140000000000001 113.677 -176.495 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -116.55 138.14 14.16 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 109.607 -1.397 . . . . 73.209999999999994 109.607 163.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.67 143.31 51.09 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 117.8 0.8 . . . . 73.530000000000001 112.302 -172.271 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -154.59 143.78 21.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.103 -0.953 . . . . 64.519999999999996 109.097 175.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.448 HD13 ' N ' ' A' ' 536' ' ' ALA . 3.2 tm? -127.02 135.73 51.24 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.852 -0.425 . . . . 53.030000000000001 109.852 -176.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.691 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -135.43 159.99 39.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.267 -0.424 . . . . 74.340000000000003 110.561 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -125.56 120.42 30.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.044 -0.526 . . . . 75.409999999999997 110.218 -178.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' A' ' 522' ' ' ALA . 50.3 tp -99.67 126.99 45.78 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.264 -0.643 . . . . 71.409999999999997 109.264 178.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.423 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 66.4 mt -113.79 116.75 53.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 116.372 -0.376 . . . . 71.329999999999998 110.323 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.617 HG22 HG23 ' A' ' 465' ' ' VAL . 95.4 t -109.66 134.34 52.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.496 -0.557 . . . . 74.409999999999997 109.496 175.269 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.05 164.37 18.71 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.022 -0.733 . . . . 62.109999999999999 109.022 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -86.9 105.23 16.93 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.571 -0.529 . . . . 64.400000000000006 109.571 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 53.6 pttt . . . . . 0 C--O 1.247 0.929 0 CA-C-N 115.679 -0.691 . . . . 74.25 109.471 178.241 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.527 -0.629 . . . . 50.039999999999999 111.527 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 21.5 t -145.21 175.06 10.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.791 0.296 . . . . 53.299999999999997 110.427 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -133.06 135.56 45.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.33 -0.619 . . . . 75.329999999999998 109.33 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 24.0 ptm -82.58 136.75 45.1 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-O 120.749 0.309 . . . . 70.120000000000005 111.499 -175.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -69.76 135.34 30.22 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.133 1.889 . . . . 62.439999999999998 110.644 171.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.575 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 58.8 t -65.95 114.24 3.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.918 0.389 . . . . 73.329999999999998 110.883 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 44.5 tp -89.2 157.77 18.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.686 -0.688 . . . . 50.009999999999998 110.545 -177.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.579 HD13 HD23 ' A' ' 527' ' ' LEU . 37.5 mt -101.96 112.61 35.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.052 -0.522 . . . . 75.129999999999995 110.087 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 20.9 p -86.49 -26.91 24.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.29 -0.414 . . . . 63.539999999999999 111.556 -176.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.503 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 7.1 tpt180 -107.1 114.35 61.42 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.277 -0.42 . . . . 74.420000000000002 110.091 177.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 459' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 458' ' ' ARG . 37.4 Cg_endo -65.95 158.12 55.78 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 122.589 2.193 . . . . 62.109999999999999 111.446 176.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.625 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 8.8 mp -73.61 160.45 31.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.115 -0.493 . . . . 43.539999999999999 110.574 -178.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 461' ' ' GLU . . . . . 0.479 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 0.2 OUTLIER -65.0 146.99 54.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.512 0.673 . . . . 72.439999999999998 112.216 -173.599 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -104.35 7.36 35.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.933 -1.031 . . . . 71.540000000000006 112.515 -171.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 463' ' ' GLN . . . . . 0.478 HE22 ' HB3' ' A' ' 461' ' ' GLU . 0.2 OUTLIER -124.49 154.13 40.99 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.872 -0.731 . . . . 72.239999999999995 111.805 -167.745 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.695 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.3 pt? -118.44 145.46 45.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.825 -1.079 . . . . 70.010000000000005 111.414 -168.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.443 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 29.3 m -119.77 177.15 3.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 53.130000000000003 111.485 -176.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -107.83 172.03 7.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.919 -0.582 . . . . 74.219999999999999 110.383 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 40.3 t -62.45 130.31 26.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.455 -0.339 . . . . 72.430000000000007 110.995 -178.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 90.54 7.37 67.02 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.776 -0.726 . . . . 62.240000000000002 112.626 178.181 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -117.85 138.73 51.91 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.884 0.373 . . . . 72.239999999999995 110.525 178.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 470' ' ' ARG . . . . . 0.554 ' HB2' HD11 ' A' ' 513' ' ' ILE . 0.0 OUTLIER -82.02 153.6 26.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.697 -0.683 . . . . 65.209999999999994 111.451 -179.124 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.433 HG12 ' HB ' ' A' ' 514' ' ' ILE . 7.4 p -145.42 131.08 13.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.991 -0.549 . . . . 73.019999999999996 110.58 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.437 ' CG ' HD13 ' A' ' 513' ' ' ILE . 41.0 mt-10 -99.37 128.21 45.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.433 -0.349 . . . . 74.299999999999997 110.964 177.121 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.479 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 92.9 m-85 -107.6 112.16 24.75 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.625 -0.88 . . . . 74.040000000000006 108.625 167.57 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -96.45 140.24 31.38 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.232 0.539 . . . . 75.099999999999994 110.623 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.591 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 8.7 p -139.25 137.81 36.24 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.451 -0.795 . . . . 75.310000000000002 109.779 176.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.503 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 45.3 mt-10 -119.46 138.98 52.78 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.529 -0.545 . . . . 70.5 109.529 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.575 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 9.6 m -122.58 152.14 26.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 116.106 -0.497 . . . . 74.409999999999997 110.917 -177.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 6.5 m -63.19 -19.63 64.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.818 -0.628 . . . . 61.130000000000003 112.094 -178.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 479' ' ' GLU . . . . . 0.499 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 35.8 tt0 -108.75 135.25 50.28 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.819 0.342 . . . . 75.319999999999993 110.437 -176.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 480' ' ' GLU . . . . . 0.667 ' HA ' ' HG2' ' A' ' 508' ' ' GLN . 13.7 pt-20 -75.49 135.96 40.64 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.177 -0.465 . . . . 71.340000000000003 110.577 -178.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 481' ' ' GLY . . . . . 0.445 ' HA2' ' HD3' ' A' ' 505' ' ' LYS . . . 67.05 8.74 51.26 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.145 -0.55 . . . . 41.109999999999999 113.075 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.527 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -57.67 139.59 53.36 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 120.849 0.356 . . . . 74.230000000000004 111.221 -177.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -79.43 128.29 33.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.648 -0.705 . . . . 65.129999999999995 110.143 -177.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.619 ' HB ' HD11 ' A' ' 527' ' ' LEU . 32.7 m -121.88 150.85 25.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.253 -0.431 . . . . 73.150000000000006 110.258 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -134.83 134.98 41.39 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.766 -0.457 . . . . 63.229999999999997 109.766 179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 486' ' ' TRP . . . . . 0.431 ' CD2' HD22 ' A' ' 512' ' ' LEU . 72.0 m95 -103.34 131.46 50.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.919 0.39 . . . . 75.519999999999996 111.165 -175.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 487' ' ' LEU . . . . . 0.567 ' HG ' ' HA ' ' A' ' 492' ' ' GLU . 10.7 mp -120.02 158.02 27.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.903 -0.589 . . . . 72.140000000000001 109.47 174.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.468 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 1.7 tmmm? -140.81 109.27 5.88 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.116 -0.327 . . . . 75.450000000000003 110.116 -178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 57.63 35.4 25.64 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.898 -0.592 . . . . 74.420000000000002 111.061 -177.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 86.94 -11.78 63.76 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.778 -0.646 . . . . 72.239999999999995 112.741 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 60.7 t -79.03 122.95 35.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.805 -0.443 . . . . 44.32 109.805 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 492' ' ' GLU . . . . . 0.567 ' HA ' ' HG ' ' A' ' 487' ' ' LEU . 33.4 tt0 -78.71 111.31 14.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.902 -0.59 . . . . 72.25 110.2 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 86.9 mt -68.37 134.94 51.03 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.016 0.436 . . . . 61.030000000000001 110.177 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 14.3 t -91.58 160.16 15.54 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.978 -0.555 . . . . 71.219999999999999 110.024 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 -125.82 11.94 7.84 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.813 -0.63 . . . . 74.310000000000002 110.559 -177.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -75.55 -35.06 60.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.613 -0.721 . . . . 53.539999999999999 109.801 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -136.23 139.6 42.86 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.621 -0.881 . . . . 73.310000000000002 108.621 170.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.562 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.6 OUTLIER -150.37 88.01 1.48 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.434 0.635 . . . . 63.509999999999998 111.166 179.094 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -104.94 -17.97 14.35 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.591 -0.732 . . . . 52.240000000000002 109.912 174.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -92.72 -47.05 7.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.733 -0.667 . . . . 65.409999999999997 109.841 174.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.562 ' O ' ' HB ' ' A' ' 498' ' ' THR . 45.6 m-85 -103.17 161.21 13.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.928 -0.578 . . . . 70.129999999999995 109.926 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 502' ' ' ARG . . . . . 0.472 ' HB2' HG23 ' A' ' 513' ' ' ILE . 49.1 mtp180 -144.34 135.49 25.35 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.175 -0.676 . . . . 61.399999999999999 109.175 174.09 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -107.4 113.14 26.31 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.475 -0.565 . . . . 73.230000000000004 109.475 -175.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -120.4 145.83 46.8 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.858 -0.61 . . . . 62.210000000000001 110.968 -172.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.445 ' HD3' ' HA2' ' A' ' 481' ' ' GLY . 3.7 ttmp? -128.82 118.42 22.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.847 -0.615 . . . . 73.140000000000001 109.846 -178.121 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 506' ' ' ASP . . . . . 0.54 ' HB3' ' HG3' ' A' ' 509' ' ' ARG . 15.3 t70 -127.62 82.73 2.1 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.421 -0.585 . . . . 73.310000000000002 109.421 177.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.37 -101.18 0.59 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.059 -0.591 . . . . 75.420000000000002 112.041 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.667 ' HG2' ' HA ' ' A' ' 480' ' ' GLU . 20.9 mt-30 -109.19 -8.63 15.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.824 0.345 . . . . 73.420000000000002 110.822 -179.394 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.54 ' HG3' ' HB3' ' A' ' 506' ' ' ASP . 36.7 ptt180 -104.94 133.25 50.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.363 0.601 . . . . 60.100000000000001 110.761 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 510' ' ' HIS . . . . . 0.591 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 83.2 m-70 -113.65 144.62 42.61 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.818 -0.628 . . . . 73.420000000000002 109.792 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -119.8 118.32 30.51 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 110.134 -0.321 . . . . 71.010000000000005 110.134 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.431 HD22 ' CD2' ' A' ' 486' ' ' TRP . 53.2 tp -96.55 103.5 15.42 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.597 -0.89 . . . . 64.200000000000003 108.597 170.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.554 HD11 ' HB2' ' A' ' 470' ' ' ARG . 5.4 tp -101.34 112.63 34.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 121.482 0.658 . . . . 61.520000000000003 110.505 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.519 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 60.9 mt -86.46 115.53 27.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 108.482 -0.933 . . . . 64.200000000000003 108.482 174.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -68.82 -51.52 39.84 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.961 0.41 . . . . 72.340000000000003 110.537 -177.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -133.76 109.41 9.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.802 -0.636 . . . . 74.530000000000001 109.841 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -88.0 138.43 31.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.974 0.416 . . . . 71.409999999999997 111.017 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 518' ' ' MET . . . . . 0.648 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 25.4 mmt -109.34 170.12 8.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.923 -0.58 . . . . 62.119999999999997 110.371 179.087 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.556 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.0 mm? -64.24 -53.52 47.78 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.241 -0.436 . . . . 72.129999999999995 111.229 -173.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -81.38 -5.06 57.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.262 -0.426 . . . . 75.430000000000007 110.907 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 521' ' ' ASP . . . . . 0.648 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 7.9 t70 -86.8 -14.56 41.87 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.088 -0.505 . . . . 74.019999999999996 110.57 -176.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.673 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -69.16 -43.67 73.81 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.817 -0.353 . . . . 75.510000000000005 111.344 -175.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 523' ' ' GLY . . . . . 0.468 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 40.27 -158.53 0.02 OUTLIER Glycine 0 CA--C 1.524 0.655 0 N-CA-C 115.9 1.12 . . . . 74.409999999999997 115.9 172.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -111.14 111.55 22.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.78 -0.71 . . . . 73.129999999999995 109.086 170.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 525' ' ' TYR . . . . . 0.454 ' HH ' ' HE1' ' A' ' 501' ' ' TYR . 40.4 m-85 -86.19 131.53 34.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.028 0.442 . . . . 71.239999999999995 111.103 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -132.27 126.09 32.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.589 -0.732 . . . . 72.209999999999994 110.073 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.619 HD11 ' HB ' ' A' ' 484' ' ' VAL . 45.5 tp -86.9 119.92 27.63 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.196 -0.456 . . . . 73.230000000000004 110.12 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 528' ' ' CYS . . . . . 0.504 ' SG ' HD13 ' A' ' 487' ' ' LEU . 86.4 m -100.88 112.97 25.51 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.457 -0.571 . . . . 61.32 109.457 177.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.533 HG23 HG12 ' A' ' 484' ' ' VAL . 0.2 OUTLIER -115.89 -168.39 1.41 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.642 -0.708 . . . . 40.0 110.389 -175.946 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 530' ' ' SER . . . . . 0.447 ' H ' HG22 ' A' ' 529' ' ' THR . 7.5 m -55.21 7.25 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.935 1.294 . . . . 22.420000000000002 113.694 173.621 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 531' ' ' GLY . . . . . 0.524 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.9 26.83 2.01 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-O 121.638 0.577 . . . . 72.430000000000007 111.831 -168.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -114.91 150.23 18.74 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 109.684 -1.366 . . . . 52.409999999999997 109.684 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.77 142.75 46.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 117.55 0.675 . . . . 72.030000000000001 110.762 -176.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -153.06 123.48 7.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.656 -0.702 . . . . 72.439999999999998 109.778 177.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.438 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.7 tm? -103.99 132.82 49.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.173 -0.467 . . . . 74.510000000000005 110.114 -177.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.625 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -121.02 149.25 42.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.37 -0.377 . . . . 53.109999999999999 110.42 177.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -116.31 120.58 39.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.173 -0.467 . . . . 62.119999999999997 110.084 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 522' ' ' ALA . 48.3 tp -127.51 134.73 49.78 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.284 -0.416 . . . . 71.420000000000002 110.462 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.579 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.8 mp -130.8 125.23 58.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.128 -0.693 . . . . 64.129999999999995 109.128 174.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.673 HG23 ' HB2' ' A' ' 522' ' ' ALA . 70.1 t -104.41 143.71 15.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 110.02 -0.363 . . . . 63.32 110.02 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 18.0 mp0 -126.29 150.26 48.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.756 0.312 . . . . 63.299999999999997 110.628 -176.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 542' ' ' GLU . . . . . 0.556 ' HG3' HD11 ' A' ' 519' ' ' LEU . 45.2 mt-10 -89.5 123.33 33.51 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.698 -0.683 . . . . 55.25 110.185 175.611 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 543' ' ' LYS . . . . . 0.509 ' C ' ' HD2' ' A' ' 543' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.89 0 CA-C-N 115.6 -0.727 . . . . 72.439999999999998 109.809 177.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.686 0 N-CA-C 111.868 -0.493 . . . . 61.210000000000001 111.868 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 43.2 p -106.12 -172.55 2.11 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.103 -0.332 . . . . 62.43 110.103 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -77.34 63.8 2.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.394 0.616 . . . . 72.230000000000004 110.543 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 23.4 ptm -115.22 132.57 22.99 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.449 -0.796 . . . . 51.100000000000001 110.107 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.75 135.62 57.3 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.235 1.957 . . . . 42.219999999999999 111.662 175.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.495 ' H ' ' HB2' ' A' ' 530' ' ' SER . 87.2 t -64.51 108.79 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.215 0.531 . . . . 64.420000000000002 110.408 178.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 50.1 tp -80.63 139.29 36.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.595 -0.73 . . . . 73.540000000000006 110.17 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 55.1 mt -91.14 114.93 29.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.867 -0.606 . . . . 72.319999999999993 109.789 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 24.7 p -86.2 -17.96 33.44 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.264 0.554 . . . . 75.329999999999998 111.498 -175.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.42 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 10.9 tpt85 -136.95 104.64 8.87 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.955 -0.566 . . . . 73.450000000000003 110.359 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 459' ' ' PRO . . . . . 0.41 ' HA ' ' HB1' ' A' ' 534' ' ' ALA . 26.2 Cg_exo -62.71 167.38 11.87 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.891 2.394 . . . . 54.32 111.285 174.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.689 ' HB2' ' CB ' ' A' ' 536' ' ' ALA . 0.8 OUTLIER -69.81 167.84 16.37 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.606 -0.516 . . . . 63.530000000000001 109.606 -177.79 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 461' ' ' GLU . . . . . 0.531 ' OE1' ' HA ' ' A' ' 461' ' ' GLU . 2.4 tp10 -73.15 161.59 30.42 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.264 0.554 . . . . 74.340000000000003 111.64 -172.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -104.25 8.76 36.16 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.989 1.107 . . . . 74.519999999999996 113.989 -166.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.11 154.23 37.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.381 0.991 . . . . 54.229999999999997 112.471 -165.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.686 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.5 pt? -106.56 146.83 30.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.051 -1.431 . . . . 74.299999999999997 111.576 -170.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.466 HG22 HD11 ' A' ' 538' ' ' LEU . 30.1 m -123.36 177.41 4.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.006 0.431 . . . . 65.319999999999993 111.457 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -97.5 166.75 11.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.008 -0.542 . . . . 74.230000000000004 110.986 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 467' ' ' VAL . . . . . 0.409 HG22 HG12 ' A' ' 540' ' ' VAL . 38.3 t -62.08 127.35 21.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.716 -0.675 . . . . 33.25 111.604 -176.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 88.16 -13.35 61.82 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.003 -0.617 . . . . 72.040000000000006 113.144 174.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -87.58 144.58 26.62 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.95 -0.389 . . . . 61.009999999999998 109.95 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 470' ' ' ARG . . . . . 0.627 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 2.3 ppt_? -76.65 145.56 38.74 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.276 0.56 . . . . 65.219999999999999 111.234 -177.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.445 HG12 ' HB ' ' A' ' 514' ' ' ILE . 7.2 p -131.9 142.26 43.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.674 -0.694 . . . . 72.430000000000007 109.978 178.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.562 ' HG2' HD13 ' A' ' 513' ' ' ILE . 34.1 mt-10 -112.19 125.3 53.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 75.540000000000006 110.546 -176.217 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.525 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 59.6 m-85 -112.88 123.2 49.77 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.287 -0.415 . . . . 65.109999999999999 111.34 178.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -95.02 138.33 32.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.736 -0.666 . . . . 63.420000000000002 110.543 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.644 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 6.0 p -148.81 133.3 17.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.25 -0.432 . . . . 53.399999999999999 110.387 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.48 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 43.9 mt-10 -131.78 139.81 49.02 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.36 -0.237 . . . . 64.409999999999997 110.36 -178.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 30.1 m -123.41 161.15 25.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.343 -0.39 . . . . 72.120000000000005 110.488 177.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 34.3 t -80.9 8.47 8.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.271 -0.422 . . . . 53.520000000000003 112.114 -175.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 479' ' ' GLU . . . . . 0.546 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 4.5 tp10 -128.85 141.27 51.35 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.029 -0.359 . . . . 70.400000000000006 110.029 -179.194 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 480' ' ' GLU . . . . . 0.51 ' HA ' ' HG2' ' A' ' 508' ' ' GLN . 1.0 OUTLIER -88.84 136.92 32.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.746 0.308 . . . . 74.409999999999997 110.426 -178.954 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 60.55 31.75 75.79 Favored Glycine 0 C--N 1.33 0.217 0 C-N-CA 120.706 -0.759 . . . . 71.129999999999995 111.783 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.546 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -74.46 146.27 42.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.951 0.405 . . . . 63.25 111.303 -175.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 483' ' ' GLN . . . . . 0.527 ' CD ' ' H ' ' A' ' 483' ' ' GLN . 4.0 pm0 -78.2 111.33 14.02 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.764 -0.653 . . . . 63.140000000000001 110.326 179.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.68 HG12 HG22 ' A' ' 529' ' ' THR . 17.3 m -131.86 151.21 34.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.666 -0.697 . . . . 71.400000000000006 110.245 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -135.06 155.13 51.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.902 0.382 . . . . 75.040000000000006 110.196 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 486' ' ' TRP . . . . . 0.584 ' HB3' HD12 ' A' ' 493' ' ' LEU . 52.2 m95 -105.57 127.24 52.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.132 -0.486 . . . . 63.539999999999999 110.908 -179.07 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 487' ' ' LEU . . . . . 0.554 HD12 ' SG ' ' A' ' 528' ' ' CYS . 65.1 mt -123.96 136.59 54.41 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.847 -0.615 . . . . 73.010000000000005 109.415 175.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.501 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 3.3 tmmm? -120.65 106.47 11.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.303 -0.408 . . . . 71.230000000000004 110.215 -177.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 489' ' ' ASP . . . . . 0.54 ' HB2' ' H ' ' A' ' 524' ' ' HIS . 13.7 t70 57.14 35.55 26.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.541 -0.754 . . . . 72.049999999999997 110.86 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 88.43 -3.72 85.28 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.794 -0.639 . . . . 62.240000000000002 112.513 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 89.5 t -94.69 128.2 46.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.722 0.296 . . . . 71.109999999999999 110.818 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 492' ' ' GLU . . . . . 0.524 ' HA ' ' CD2' ' A' ' 487' ' ' LEU . 4.7 tp10 -70.01 126.96 31.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.847 -0.615 . . . . 73.510000000000005 110.432 178.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.584 HD12 ' HB3' ' A' ' 486' ' ' TRP . 75.8 mt -87.55 98.01 11.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.119 0.485 . . . . 60.340000000000003 109.753 175.447 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 494' ' ' THR . . . . . 0.504 ' OG1' ' HG2' ' A' ' 496' ' ' GLU . 6.2 t -64.27 123.33 18.84 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.599 -0.728 . . . . 72.040000000000006 111.223 -176.439 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 495' ' ' ARG . . . . . 0.636 ' H ' ' NE ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -100.61 13.07 35.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.042 -0.526 . . . . 62.340000000000003 110.768 -179.264 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 496' ' ' GLU . . . . . 0.504 ' HG2' ' OG1' ' A' ' 494' ' ' THR . 10.1 mm-40 -69.22 -36.66 77.48 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.325 -0.62 . . . . 74.319999999999993 109.325 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -151.53 108.22 3.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.143 -0.935 . . . . 71.510000000000005 109.364 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.6 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 21.3 p -114.42 97.8 6.53 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.154 -0.475 . . . . 73.450000000000003 111.547 -176.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -91.03 -28.95 17.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.9 -0.591 . . . . 74.120000000000005 110.192 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -88.76 -46.97 8.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.941 -0.572 . . . . 75.450000000000003 110.312 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.6 ' O ' ' HB ' ' A' ' 498' ' ' THR . 26.2 m-85 -99.32 154.96 17.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.624 -0.716 . . . . 65.040000000000006 110.093 -176.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 502' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 501' ' ' TYR . 21.5 mtp85 -148.09 123.17 10.12 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.549 -0.537 . . . . 75.530000000000001 109.549 171.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 503' ' ' PHE . . . . . 0.464 ' HE2' HG21 ' A' ' 498' ' ' THR . 72.6 m-85 -96.06 118.37 32.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.02 -0.537 . . . . 72.319999999999993 111.465 -172.042 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 4.6 mptp? -105.85 146.0 30.49 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.239 -0.437 . . . . 62.210000000000001 110.054 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 26.5 ttpt -129.37 128.06 42.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.85 0.357 . . . . 71.549999999999997 111.149 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -119.05 79.03 1.34 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.657 -0.701 . . . . 75.129999999999995 109.512 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.49 -90.78 0.24 Allowed Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.838 -0.619 . . . . 53.130000000000003 112.807 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.51 ' HG2' ' HA ' ' A' ' 480' ' ' GLU . 22.7 mt-30 -99.14 -26.06 14.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.804 0.335 . . . . 61.100000000000001 111.019 -177.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.48 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 17.1 ptt180 -103.55 153.74 20.24 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.21 0.529 . . . . 72.030000000000001 111.485 -173.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 510' ' ' HIS . . . . . 0.644 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 74.9 m80 -124.64 156.54 37.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.045 -0.525 . . . . 74.109999999999999 110.76 -179.249 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 511' ' ' HIS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 42.0 m-70 -125.99 119.3 27.34 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.08 -0.711 . . . . 75.140000000000001 109.08 176.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.525 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 64.4 tp -98.3 105.68 17.86 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.447 -0.575 . . . . 75.239999999999995 109.447 174.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.562 HD13 ' HG2' ' A' ' 472' ' ' GLU . 8.5 tp -97.54 112.81 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 CA-C-O 121.502 0.668 . . . . 44.420000000000002 109.571 176.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.627 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 45.1 mt -96.66 112.08 28.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.611 -0.885 . . . . 61.030000000000001 108.611 175.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -68.81 -45.01 72.32 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.445 0.466 . . . . 74.030000000000001 111.353 -173.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -134.32 109.59 8.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.198 -0.456 . . . . 42.43 110.185 178.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.542 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -88.27 123.07 32.51 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.097 -0.501 . . . . 52.450000000000003 110.344 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 518' ' ' MET . . . . . 0.724 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 30.2 mmt -90.05 173.36 8.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.256 -0.429 . . . . 75.120000000000005 110.103 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.32 -54.03 50.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.949 0.404 . . . . 75.099999999999994 110.853 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -82.89 -4.48 58.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.752 -0.658 . . . . 53.25 111.103 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 521' ' ' ASP . . . . . 0.724 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 6.8 t70 -80.41 -19.78 45.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.305 -176.308 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.527 ' HA ' HD23 ' A' ' 538' ' ' LEU . . . -62.66 -41.93 99.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.147 -0.479 . . . . 64.200000000000003 111.268 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.19 -157.32 0.07 OUTLIER Glycine 0 C--N 1.335 0.513 0 O-C-N 123.924 0.765 . . . . 65.200000000000003 114.811 173.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 524' ' ' HIS . . . . . 0.54 ' H ' ' HB2' ' A' ' 489' ' ' ASP . 60.5 m80 -120.66 108.65 14.27 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.734 -0.839 . . . . 74.25 108.734 171.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 525' ' ' TYR . . . . . 0.501 ' CZ ' ' HG3' ' A' ' 488' ' ' LYS . 26.3 m-85 -85.46 132.04 34.28 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.472 0.654 . . . . 74.200000000000003 111.857 -173.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -141.29 131.86 25.46 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.113 -0.949 . . . . 44.020000000000003 109.818 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.49 HD22 ' HB2' ' A' ' 475' ' ' CYS . 61.2 tp -86.67 116.3 24.69 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.245 -0.65 . . . . 71.439999999999998 109.245 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 528' ' ' CYS . . . . . 0.554 ' SG ' HD12 ' A' ' 487' ' ' LEU . 64.6 m -99.73 116.31 31.52 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.424 0.63 . . . . 63.219999999999999 110.597 -176.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.68 HG22 HG12 ' A' ' 484' ' ' VAL . 68.0 p -115.64 -165.67 1.06 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.95 -1.023 . . . . 71.430000000000007 110.229 -177.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 530' ' ' SER . . . . . 0.495 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 2.7 m -52.68 4.25 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.645 1.178 . . . . 70.040000000000006 113.274 172.641 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 531' ' ' GLY . . . . . 0.522 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.85 27.59 1.87 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.392 -0.432 . . . . 72.109999999999999 113.233 -175.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -107.95 136.22 13.32 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 109.797 -1.321 . . . . 54.219999999999999 109.797 164.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -113.03 121.06 43.48 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 117.201 0.5 . . . . 72.430000000000007 112.224 -171.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 534' ' ' ALA . . . . . 0.41 ' HB1' ' HA ' ' A' ' 459' ' ' PRO . . . -121.26 140.21 52.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.933 -0.576 . . . . 74.010000000000005 109.474 171.123 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.492 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.8 tm? -128.36 138.94 52.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.767 0.318 . . . . 72.439999999999998 110.48 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.689 ' CB ' ' HB2' ' A' ' 460' ' ' LEU . . . -146.94 159.92 42.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 74.530000000000001 110.112 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -127.04 116.75 21.21 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.057 0.456 . . . . 73.120000000000005 111.057 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.527 HD23 ' HA ' ' A' ' 522' ' ' ALA . 52.6 tp -101.22 133.08 46.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.038 -0.727 . . . . 74.420000000000002 109.038 175.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.68 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 35.5 mt -125.49 116.7 47.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 109.762 -0.459 . . . . 74.219999999999999 109.762 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.542 HG21 ' HB1' ' A' ' 517' ' ' ALA . 97.8 t -112.81 120.16 62.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 120.771 0.319 . . . . 54.539999999999999 110.513 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -131.58 162.21 30.86 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.943 -0.571 . . . . 55.520000000000003 109.798 -179.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -85.33 109.12 18.16 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.44 -0.578 . . . . 61.310000000000002 109.44 173.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 543' ' ' LYS . . . . . 0.838 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 10.7 mmpt? . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.426 -0.797 . . . . 71.310000000000002 109.701 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.726 0 N-CA-C 111.901 -0.48 . . . . 53.140000000000001 111.901 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 20.7 t -87.14 124.49 33.32 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 72.209999999999994 110.225 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 41.3 m-70 -77.17 125.15 28.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.822 -0.626 . . . . 75.439999999999998 110.319 177.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' MET . . . . . 0.468 ' O ' ' HG3' ' A' ' 452' ' ' MET . 18.9 ptm -109.27 113.85 58.28 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 115.943 -0.571 . . . . 71.129999999999995 109.666 176.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 453' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 452' ' ' MET . 29.5 Cg_endo -63.96 151.31 85.79 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.307 2.005 . . . . 74.120000000000005 111.287 177.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.435 ' H ' ' HB2' ' A' ' 530' ' ' SER . 99.2 t -64.93 107.67 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-O 121.199 0.523 . . . . 54.329999999999998 110.063 176.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 47.3 tp -93.63 152.54 18.93 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.512 -0.767 . . . . 72.409999999999997 109.562 -177.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 56.6 mt -105.71 112.9 41.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.205 -0.452 . . . . 74.420000000000002 110.234 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 43.8 p -86.43 -33.91 20.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.181 0.515 . . . . 70.230000000000004 110.416 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.485 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 14.3 tpt180 -114.77 103.91 54.54 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.541 -0.754 . . . . 75.540000000000006 109.26 174.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.2 167.57 19.86 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.968 2.445 . . . . 65.439999999999998 112.272 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.878 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 79.6 mt -66.11 155.24 37.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.032 -0.531 . . . . 74.099999999999994 110.078 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -88.35 162.68 16.42 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.302 0.853 . . . . 73.310000000000002 113.302 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -104.53 6.33 34.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.245 -1.343 . . . . 72.540000000000006 113.93 -161.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -123.86 149.31 45.94 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 118.923 -1.111 . . . . 62.420000000000002 112.753 -162.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.612 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 0.6 OUTLIER -114.48 144.9 42.6 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.97 -1.468 . . . . 71.400000000000006 111.391 -170.523 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 28.2 m -117.92 177.93 2.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.115 -0.493 . . . . 63.219999999999999 111.303 -177.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -103.14 168.07 9.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.012 -0.54 . . . . 71.329999999999998 110.382 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 45.0 t -62.21 130.33 26.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.472 -0.331 . . . . 72.239999999999995 110.829 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 92.46 -11.22 72.61 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.877 -0.678 . . . . 45.210000000000001 112.616 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -101.09 144.17 30.32 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.431 -0.581 . . . . 73.420000000000002 109.431 178.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 470' ' ' ARG . . . . . 0.494 ' C ' ' HD2' ' A' ' 470' ' ' ARG . 0.0 OUTLIER -86.01 150.61 24.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.965 0.412 . . . . 64.129999999999995 110.72 -176.13 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.413 HG12 ' HB ' ' A' ' 514' ' ' ILE . 8.0 p -128.94 137.59 56.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.445 -0.576 . . . . 55.329999999999998 109.445 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.852 ' HG2' HG13 ' A' ' 513' ' ' ILE . 42.6 mt-10 -116.61 124.28 49.41 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.489 -0.323 . . . . 73.25 110.159 -176.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.456 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 76.9 m-85 -107.97 113.27 26.33 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.116 -0.493 . . . . 65.209999999999994 110.286 176.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -95.61 132.36 40.84 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.657 -0.701 . . . . 74.349999999999994 110.295 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.4 t -148.26 121.02 8.66 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.095 0.474 . . . . 53.43 110.507 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.902 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 46.5 mt-10 -112.63 138.72 49.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.799 -0.637 . . . . 73.319999999999993 110.058 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.508 HG21 ' HB3' ' A' ' 482' ' ' ALA . 21.6 m -121.93 178.44 2.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.383 -0.371 . . . . 65.409999999999997 110.781 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 25.0 p -78.22 -21.61 49.73 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.598 0.592 . . . . 50.100000000000001 112.598 -174.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 479' ' ' GLU . . . . . 0.674 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 35.9 tt0 -119.02 138.91 52.5 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.997 0.427 . . . . 73.209999999999994 110.991 -175.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 480' ' ' GLU . . . . . 0.426 ' H ' ' CD ' ' A' ' 480' ' ' GLU . 1.4 pm0 -74.41 126.96 31.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.955 -0.566 . . . . 43.399999999999999 110.368 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 64.35 26.84 70.93 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.616 -0.802 . . . . 52.329999999999998 111.953 -174.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.674 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -57.94 156.76 8.65 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.012 0.745 . . . . 62.329999999999998 113.012 -176.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -71.86 105.48 3.82 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.886 -1.052 . . . . 64.239999999999995 109.553 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.54 ' HB ' HD11 ' A' ' 527' ' ' LEU . 29.3 m -128.06 150.7 34.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.908 0.385 . . . . 73.099999999999994 110.412 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 49.4 tttp -130.29 126.8 38.13 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.206 -0.664 . . . . 63.140000000000001 109.206 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 486' ' ' TRP . . . . . 0.412 ' HB3' HD12 ' A' ' 493' ' ' LEU . 86.1 m95 -100.92 116.81 33.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.739 0.304 . . . . 73.439999999999998 110.885 -175.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 487' ' ' LEU . . . . . 0.415 HD13 ' SG ' ' A' ' 528' ' ' CYS . 7.7 mp -118.23 140.8 49.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.035 -0.529 . . . . 61.229999999999997 110.393 177.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.537 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 4.2 tmmm? -127.22 107.45 10.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.142 -0.688 . . . . 50.25 109.142 176.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 4.7 t70 58.56 35.55 24.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.577 0.703 . . . . 73.120000000000005 110.353 -178.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 92.99 -15.58 62.5 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.824 -0.703 . . . . 70.540000000000006 113.281 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 55.9 t -97.85 123.99 50.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.81 0.305 . . . . 72.430000000000007 110.561 -178.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -70.44 142.6 51.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.932 0.396 . . . . 74.040000000000006 110.75 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.708 HD11 ' HE2' ' A' ' 525' ' ' TYR . 59.7 mt -84.71 118.39 24.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.901 -0.59 . . . . 75.409999999999997 110.197 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 10.6 t -70.46 143.14 51.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.06 0.457 . . . . 72.209999999999994 110.414 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.93 7.64 11.52 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.177 -0.465 . . . . 74.439999999999998 110.596 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -62.18 -50.38 72.06 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.517 0.675 . . . . 75.019999999999996 109.579 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -152.65 118.16 5.3 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.81 -1.086 . . . . 75.519999999999996 108.82 174.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.61 121.65 16.76 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.85 0.357 . . . . 73.439999999999998 110.597 -176.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -107.49 -22.9 12.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.272 -0.422 . . . . 64.340000000000003 111.51 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 500' ' ' LYS . . . . . 0.411 ' HE3' ' CE2' ' A' ' 501' ' ' TYR . 52.3 mtmt -73.97 -46.74 42.01 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.422 -0.585 . . . . 64.230000000000004 109.422 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.728 ' HB3' HG12 ' A' ' 514' ' ' ILE . 0.6 OUTLIER -136.09 144.98 45.45 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.282 -0.872 . . . . 73.510000000000005 110.298 179.032 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.88 140.32 51.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.068 0.461 . . . . 74.120000000000005 110.922 178.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -95.64 120.55 36.09 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.242 -0.89 . . . . 64.209999999999994 109.789 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 0.7 OUTLIER -113.54 121.31 43.83 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.072 0.463 . . . . 74.439999999999998 110.964 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -107.51 113.51 26.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.588 -0.733 . . . . 73.310000000000002 110.476 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.53 101.4 3.98 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.426 0.631 . . . . 74.0 110.581 174.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 80.06 -131.14 10.3 Favored Glycine 0 N--CA 1.444 -0.83 0 CA-C-N 115.456 -0.793 . . . . 52.240000000000002 111.895 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.451 ' HB3' ' O ' ' A' ' 477' ' ' VAL . 26.0 mt-30 -93.47 -10.63 34.34 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.817 0.341 . . . . 61.520000000000003 110.567 -178.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.902 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 25.5 ptt180 -93.52 143.83 25.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.546 0.688 . . . . 71.099999999999994 111.508 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 -124.5 117.71 24.98 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.441 -0.948 . . . . 73.329999999999998 108.441 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 511' ' ' HIS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 13.3 m-70 -101.84 127.57 48.59 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.677 -0.238 . . . . 73.310000000000002 110.739 -172.524 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.456 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 63.0 tp -112.7 103.55 11.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.596 -0.52 . . . . 73.439999999999998 109.596 173.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.852 HG13 ' HG2' ' A' ' 472' ' ' GLU . 1.7 mp -105.08 116.28 48.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.1 -0.5 . . . . 60.43 110.329 179.248 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.728 HG12 ' HB3' ' A' ' 501' ' ' TYR . 53.7 mt -97.81 112.78 30.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.075 -0.713 . . . . 73.5 109.075 175.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -71.19 -44.25 65.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.091 -0.504 . . . . 72.319999999999993 110.542 -175.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -129.86 109.14 10.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.911 -0.586 . . . . 64.109999999999999 109.758 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -89.98 132.16 35.5 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.062 -0.517 . . . . 70.209999999999994 110.335 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 26.1 mmt -112.06 166.51 11.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.076 -0.511 . . . . 71.329999999999998 110.554 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.516 HD22 ' H ' ' A' ' 519' ' ' LEU . 2.9 mm? -58.18 -53.92 52.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 71.209999999999994 111.077 -174.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -82.6 -10.78 58.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.075 -0.511 . . . . 74.420000000000002 111.651 -176.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -85.9 -14.03 46.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.44 -0.346 . . . . 73.439999999999998 110.466 -177.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.644 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -62.72 -41.98 99.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.313 -0.403 . . . . 61.350000000000001 111.361 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.68 -158.13 0.08 OUTLIER Glycine 0 C--N 1.337 0.589 0 O-C-N 123.835 0.709 . . . . 60.509999999999998 114.472 176.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -126.97 112.38 15.2 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.605 -0.887 . . . . 74.019999999999996 108.605 172.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 525' ' ' TYR . . . . . 0.708 ' HE2' HD11 ' A' ' 493' ' ' LEU . 51.7 m-85 -85.74 131.97 34.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.238 0.542 . . . . 75.209999999999994 111.494 -172.363 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -137.55 120.07 16.02 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.553 -0.749 . . . . 64.400000000000006 110.035 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.54 HD11 ' HB ' ' A' ' 484' ' ' VAL . 45.2 tp -87.6 123.35 32.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.152 -0.476 . . . . 64.310000000000002 109.775 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 528' ' ' CYS . . . . . 0.415 ' SG ' HD13 ' A' ' 487' ' ' LEU . 64.6 m -108.68 112.73 25.19 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.054 0.454 . . . . 64.310000000000002 110.202 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.55 ' C ' ' H ' ' A' ' 531' ' ' GLY . 55.1 p -114.61 -165.2 0.99 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.085 -0.507 . . . . 72.530000000000001 109.716 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 530' ' ' SER . . . . . 0.435 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 2.1 m -49.79 4.53 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.087 1.143 . . . . 71.239999999999995 114.087 173.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 531' ' ' GLY . . . . . 0.55 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.55 26.84 2.08 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 121.446 0.47 . . . . 74.120000000000005 112.789 -173.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -109.04 138.02 14.52 Favored Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 109.21 -1.556 . . . . 73.209999999999994 109.21 164.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.74 126.14 46.91 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 117.31 0.555 . . . . 64.299999999999997 111.201 -171.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 534' ' ' ALA . . . . . 0.413 ' HB1' ' H ' ' A' ' 460' ' ' LEU . . . -131.89 133.88 45.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.79 -0.641 . . . . 62.32 109.636 174.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.482 HD13 ' N ' ' A' ' 536' ' ' ALA . 1.4 tm? -116.81 133.69 55.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.933 -0.395 . . . . 72.129999999999995 109.933 -177.146 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.878 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -122.09 131.22 53.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.431 -0.35 . . . . 44.450000000000003 110.801 178.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -102.41 116.41 32.56 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.112 -0.494 . . . . 72.329999999999998 110.149 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.506 HD23 ' HA ' ' A' ' 522' ' ' ALA . 33.6 tp -124.11 118.75 27.63 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.266 -0.425 . . . . 72.099999999999994 110.088 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.612 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.2 mp -124.21 109.68 23.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 109.065 -0.717 . . . . 73.040000000000006 109.065 176.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.644 HG23 ' HB2' ' A' ' 522' ' ' ALA . 73.0 t -89.88 129.16 41.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.118 0.485 . . . . 75.510000000000005 110.249 -177.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -116.04 168.4 10.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.46 -0.791 . . . . 54.439999999999998 110.222 -174.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 542' ' ' GLU . . . . . 0.42 ' HG3' HD11 ' A' ' 519' ' ' LEU . 47.6 mt-10 -115.03 108.68 17.0 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.524 -0.307 . . . . 61.130000000000003 110.563 174.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 50.1 pttt . . . . . 0 C--O 1.247 0.93 0 CA-C-N 115.569 -0.742 . . . . 75.040000000000006 110.093 177.125 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 N--CA 1.457 -0.643 0 CA-C-O 120.916 0.298 . . . . 73.44 112.267 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.53 ' HB ' ' HB2' ' A' ' 530' ' ' SER . 65.6 t -65.94 108.78 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.295 -0.631 . . . . 73.43 109.295 172.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 54.7 tp -95.15 137.29 34.4 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.426 -0.807 . . . . 70.02 110.269 -175.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 58.1 mt -80.29 101.48 5.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.072 -0.714 . . . . 71.11 109.072 175.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 6.5 p -74.42 -18.97 60.57 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.909 -0.587 . . . . 62.42 111.964 -173.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.4 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 36.7 tpt85 -122.97 108.08 32.8 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.438 -0.346 . . . . 72.52 110.122 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.92 158.95 27.1 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 123.146 2.564 . . . . 61.24 112.48 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.61 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 94.9 mt -80.93 160.81 24.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.888 -0.596 . . . . 43.01 111.459 -174.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . 0.68 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 0.1 OUTLIER -65.91 139.59 58.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.652 -0.703 . . . . 71.43 112.069 -175.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -106.12 10.74 31.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.92 -1.037 . . . . 62.22 112.331 -173.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . 0.421 ' OE1' ' HG3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -120.63 153.03 37.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 119.685 -0.806 . . . . 51.23 112.362 -163.733 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.568 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.2 pt? -91.7 146.7 23.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.164 -1.38 . . . . 75.4 112.072 -169.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.499 HG21 HG22 ' A' ' 471' ' ' VAL . 28.2 m -125.32 178.43 3.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.822 -0.627 . . . . 64.13 111.121 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -118.36 161.65 19.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.095 -0.502 . . . . 73.32 110.775 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 52.7 t -66.17 126.59 25.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 74.03 110.738 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 95.13 -3.97 67.2 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.75 -0.738 . . . . 75.01 112.304 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -104.91 150.61 24.73 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.89 -0.411 . . . . 74.21 109.89 178.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . 0.463 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 17.3 ptp180 -81.58 153.19 26.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.984 0.421 . . . . 74.13 110.957 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.499 HG22 HG21 ' A' ' 465' ' ' VAL . 2.3 t -120.57 119.33 59.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.044 -0.525 . . . . 72.52 109.93 177.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -106.02 119.18 38.54 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.064 -0.347 . . . . 62.03 110.064 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.68 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 98.3 m-85 -108.85 139.31 43.86 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.884 -0.598 . . . . 64.35 110.28 174.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.95 123.85 50.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.544 -0.298 . . . . 73.22 110.31 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 26.8 p -149.39 135.44 18.94 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.912 0.387 . . . . 64.32 110.479 177.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.442 ' HA ' ' HA ' ' A' ' 509' ' ' ARG . 43.8 mt-10 -128.18 155.52 44.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.895 -0.593 . . . . 73.31 109.437 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.5 HG21 ' HB3' ' A' ' 482' ' ' ALA . 14.2 m -125.3 166.68 20.66 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 116.424 -0.353 . . . . 72.52 110.461 177.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 25.8 p -78.93 8.4 5.64 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.438 0.533 . . . . 61.21 112.438 -174.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . 0.566 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 37.1 tt0 -144.54 133.93 23.19 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.048 -0.353 . . . . 75.32 110.048 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -79.0 134.11 36.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.317 0.579 . . . . 72.02 110.731 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . 0.516 ' HA2' ' HD3' ' A' ' 505' ' ' LYS . . . 71.4 16.28 75.48 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.47 -0.786 . . . . 72.24 112.118 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.566 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -61.56 156.54 19.41 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.146 0.498 . . . . 61.0 111.821 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -81.25 133.6 35.47 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.344 -0.844 . . . . 63.03 109.878 -178.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.565 ' HB ' HD11 ' A' ' 527' ' ' LEU . 26.8 m -137.36 175.53 9.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.892 0.377 . . . . 73.43 110.858 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . 0.569 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 55.9 tttp -151.31 122.63 7.8 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.306 -0.627 . . . . 71.55 109.306 -177.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -101.92 120.1 39.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.858 0.361 . . . . 72.2 111.143 -176.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . 0.524 HD21 ' HE3' ' A' ' 485' ' ' LYS . 98.0 mt -120.45 135.51 55.03 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.911 -0.586 . . . . 73.15 110.411 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.413 ' HE2' ' HB3' ' A' ' 488' ' ' LYS . 5.2 tmmm? -111.88 104.77 13.09 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.572 -0.899 . . . . 73.14 108.572 174.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.31 36.66 16.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.598 -0.728 . . . . 65.32 110.877 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.08 -14.11 61.53 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.833 -0.698 . . . . 32.04 113.266 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 39.9 t -100.76 123.2 53.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 122.47 -0.429 . . . . 54.23 110.43 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . 0.422 ' HA ' HD23 ' A' ' 487' ' ' LEU . 39.3 tt0 -71.77 135.69 46.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.98 0.419 . . . . 73.04 110.78 -179.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 91.1 mt -78.42 128.26 33.36 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.953 -0.567 . . . . 74.01 110.125 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 11.8 t -80.88 138.9 36.17 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.13 0.49 . . . . 75.02 110.036 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . 0.605 ' HA ' HG23 ' A' ' 498' ' ' THR . 0.0 OUTLIER -126.02 14.24 7.9 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.834 -0.621 . . . . 73.45 110.043 -178.01 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -70.49 -34.22 72.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.478 0.656 . . . . 60.35 109.304 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -144.69 107.21 4.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.014 -0.994 . . . . 75.12 109.014 173.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.605 HG23 ' HA ' ' A' ' 495' ' ' ARG . 22.6 p -120.21 114.87 22.56 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.221 -0.445 . . . . 73.12 111.205 -176.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -111.82 -18.97 12.58 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.045 0.45 . . . . 71.05 111.039 170.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -99.38 -42.84 6.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.06 -0.518 . . . . 71.1 111.136 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.49 ' HB3' HD11 ' A' ' 512' ' ' LEU . 46.4 m-85 -107.64 138.54 43.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.368 -0.378 . . . . 74.31 110.611 -176.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 502' ' ' ARG . . . . . 0.524 ' HB2' ' CG2' ' A' ' 513' ' ' ILE . 0.8 OUTLIER -118.34 123.95 46.58 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.704 0.288 . . . . 73.3 110.418 175.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . 0.438 ' CE2' HD13 ' A' ' 512' ' ' LEU . 89.5 m-85 -103.1 112.84 25.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.743 -0.662 . . . . 72.23 109.615 178.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.559 ' HE2' HG22 ' A' ' 513' ' ' ILE . 0.0 OUTLIER -113.79 135.82 53.54 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.978 0.418 . . . . 71.13 111.005 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.516 ' HD3' ' HA2' ' A' ' 481' ' ' GLY . 20.4 ttmt -115.15 111.89 21.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.537 -0.756 . . . . 64.53 109.699 177.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . 0.422 ' HB2' ' HG2' ' A' ' 509' ' ' ARG . 32.3 m-20 -119.58 88.17 2.88 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.542 -0.54 . . . . 73.12 109.542 177.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.65 -106.45 1.76 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.611 -0.805 . . . . 55.42 112.107 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -101.54 -15.9 16.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.582 0.229 . . . . 54.25 110.701 -177.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.442 ' HA ' ' HA ' ' A' ' 476' ' ' GLU . 26.6 ptt180 -89.76 151.54 21.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.196 0.522 . . . . 74.24 110.219 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 -132.06 136.35 47.14 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.012 -0.736 . . . . 61.44 109.012 175.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -123.9 124.09 41.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.008 0.432 . . . . 63.52 111.473 177.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.49 HD11 ' HB3' ' A' ' 501' ' ' TYR . 53.1 tp -105.46 102.72 12.17 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.19 -1.041 . . . . 74.34 108.19 169.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.559 HG22 ' HE2' ' A' ' 504' ' ' LYS . 8.0 tp -98.68 113.2 32.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.668 0.746 . . . . 73.5 109.8 -179.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.463 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 60.5 mt -88.6 115.96 29.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.309 -0.86 . . . . 73.45 109.365 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -63.81 -45.37 89.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.882 0.372 . . . . 73.21 111.056 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -141.83 110.91 6.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.95 -0.568 . . . . 63.24 110.074 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -83.29 137.14 34.11 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.09 -0.505 . . . . 73.33 110.953 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . 0.596 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 26.3 mmt -107.72 170.78 7.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.919 -0.582 . . . . 70.24 110.086 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.565 ' H ' HD22 ' A' ' 519' ' ' LEU . 2.4 mm? -64.07 -54.68 30.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.178 0.513 . . . . 73.1 110.808 -173.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -82.77 -4.84 58.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.645 -0.707 . . . . 74.34 111.089 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 1.0 OUTLIER -89.3 -7.49 55.28 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.081 -0.508 . . . . 74.44 111.509 -178.496 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.637 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -74.4 -43.72 55.16 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.76 -0.376 . . . . 53.25 111.371 -177.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 41.41 -158.11 0.04 OUTLIER Glycine 0 CA--C 1.526 0.767 0 CA-C-O 121.95 0.75 . . . . 72.12 114.845 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -111.51 113.79 26.45 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.07 -0.715 . . . . 73.24 109.07 169.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . 0.594 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 60.6 m-85 -84.35 130.95 34.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.083 0.468 . . . . 64.25 110.207 -178.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -137.87 119.65 15.21 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.657 -0.701 . . . . 71.3 110.276 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.565 HD11 ' HB ' ' A' ' 484' ' ' VAL . 33.7 tp -89.78 109.59 20.57 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.255 -0.646 . . . . 73.21 109.255 178.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . 0.569 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 60.3 m -94.83 113.97 25.78 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.302 0.572 . . . . 75.13 110.24 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.511 HG22 HG12 ' A' ' 484' ' ' VAL . 55.8 p -116.13 -165.92 1.09 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.408 -0.815 . . . . 75.53 110.973 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . 0.53 ' HB2' ' HB ' ' A' ' 454' ' ' VAL . 33.1 m -52.87 5.05 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.451 1.1 . . . . 54.51 113.729 172.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . 0.511 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.79 27.44 1.91 Allowed Glycine 0 C--N 1.33 0.224 0 O-C-N 122.018 -0.426 . . . . 75.15 113.357 -177.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -111.75 134.58 12.18 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 109.658 -1.377 . . . . 72.43 109.658 164.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -119.09 120.54 37.45 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 117.193 0.496 . . . . 62.0 111.685 -172.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -121.3 143.3 49.25 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.799 -0.815 . . . . 43.12 108.799 171.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.437 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.4 tm? -128.54 133.56 48.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.001 0.429 . . . . 53.0 110.384 -174.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.61 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -127.65 131.11 49.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.915 -0.584 . . . . 54.21 110.272 176.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -113.49 115.7 28.43 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.19 -0.671 . . . . 44.32 109.19 176.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.475 HD11 HG22 ' A' ' 465' ' ' VAL . 37.6 tp -109.46 134.61 51.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.991 -0.55 . . . . 71.45 110.349 -173.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.512 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 43.1 mt -119.86 113.69 41.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.375 -0.602 . . . . 75.21 109.375 175.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.637 HG23 ' HB2' ' A' ' 522' ' ' ALA . 85.7 t -103.89 134.66 44.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.831 -0.433 . . . . 72.44 109.831 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.36 146.07 49.58 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.295 -0.411 . . . . 74.02 110.057 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -83.4 109.31 17.21 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.939 -0.763 . . . . 70.04 108.939 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . 0.785 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 10.9 mmpt? . . . . . 0 C--O 1.245 0.846 0 CA-C-O 118.306 -0.854 . . . . 72.33 109.753 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo . . . . . 0 N--CA 1.456 -0.696 0 N-CA-C 110.04 -0.792 . . . . 72.42 110.04 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.418 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 92.2 t -64.36 107.6 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.37 0.605 . . . . 72.44 110.213 -176.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 44.1 tp -106.14 162.38 13.68 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.165 -0.925 . . . . 74.21 109.465 -177.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 34.1 mt -104.58 107.54 22.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 110.041 -0.355 . . . . 72.43 110.041 -177.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . 0.5 ' O ' ' HD3' ' A' ' 459' ' ' PRO . 21.4 p -80.57 -44.01 19.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.316 0.579 . . . . 72.33 110.367 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.46 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 8.1 tpt85 -99.79 101.63 14.48 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 115.383 -0.826 . . . . 72.24 109.18 175.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . 0.5 ' HD3' ' O ' ' A' ' 457' ' ' THR . 17.0 Cg_exo -67.36 165.18 27.83 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.726 2.284 . . . . 65.43 111.493 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.694 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 3.2 mm? -65.86 166.45 11.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.357 -0.383 . . . . 75.44 110.395 -179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . 0.406 ' OE1' ' HA ' ' A' ' 461' ' ' GLU . 1.4 tp10 -69.87 157.17 37.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.481 0.657 . . . . 75.42 112.255 -172.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -105.49 7.67 33.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.883 -1.053 . . . . 63.15 113.649 -168.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -123.41 153.63 40.14 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.162 -1.015 . . . . 72.45 112.423 -167.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.658 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 1.8 pt? -108.75 145.47 35.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.177 -1.374 . . . . 72.33 110.89 -171.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.56 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 27.5 m -124.19 176.83 5.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.078 0.466 . . . . 73.44 111.21 -178.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -100.14 166.7 10.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.786 -0.643 . . . . 65.32 110.358 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . 0.419 HG21 ' HG2' ' A' ' 542' ' ' GLU . 24.5 t -60.03 138.25 21.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.329 -0.396 . . . . 73.43 111.254 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 82.18 -4.05 78.25 Favored Glycine 0 C--N 1.329 0.185 0 C-N-CA 121.192 -0.528 . . . . 55.25 112.809 176.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -102.46 143.32 32.34 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.181 -0.303 . . . . 75.44 110.181 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . 0.52 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 1.1 ptp180 -72.02 147.98 46.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.269 -0.423 . . . . 72.13 110.885 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.487 ' HB ' HG21 ' A' ' 465' ' ' VAL . 7.5 p -140.91 133.71 31.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.999 -0.546 . . . . 53.11 109.684 174.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.625 ' HG2' HD13 ' A' ' 513' ' ' ILE . 44.3 mt-10 -100.95 132.48 46.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.017 0.437 . . . . 71.55 110.968 -178.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.549 ' HB3' HD12 ' A' ' 460' ' ' LEU . 80.6 m-85 -124.09 112.28 16.94 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.042 -0.725 . . . . 74.01 109.042 169.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -118.52 138.65 52.38 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.102 0.477 . . . . 60.43 110.619 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.476 ' HB3' HD13 ' A' ' 460' ' ' LEU . 7.4 p -138.91 146.38 41.0 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.628 -0.714 . . . . 42.42 110.518 -178.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.608 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 44.3 mt-10 -116.38 138.08 51.64 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.213 -0.448 . . . . 73.14 109.821 176.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.473 HG21 ' HB3' ' A' ' 482' ' ' ALA . 14.2 m -119.27 164.83 15.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.86 -0.609 . . . . 74.13 110.874 -179.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 7.9 m -66.19 -12.87 58.75 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.723 0.638 . . . . 62.14 112.723 -174.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 40.8 tt0 -129.33 145.23 51.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.733 0.301 . . . . 75.13 110.847 -176.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . 0.525 ' CD ' ' H ' ' A' ' 480' ' ' GLU . 0.6 OUTLIER -79.69 126.95 31.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.188 -0.46 . . . . 72.12 110.541 -179.317 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 64.0 25.86 69.75 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.962 -0.637 . . . . 62.22 112.049 -176.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.602 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -58.44 152.9 16.92 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.148 0.499 . . . . 63.04 112.129 -177.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -76.32 111.95 12.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.26 -0.882 . . . . 65.31 109.875 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.6 ' HB ' HD11 ' A' ' 527' ' ' LEU . 35.2 m -124.98 150.72 30.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.172 -0.467 . . . . 64.15 111.077 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 528' ' ' CYS . 45.4 tttp -121.86 129.72 52.81 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.177 -0.675 . . . . 62.12 109.177 179.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -101.17 126.84 47.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.644 0.259 . . . . 73.51 110.477 -178.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . 0.43 HD11 ' HD3' ' A' ' 485' ' ' LYS . 5.1 mp -131.44 150.96 51.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.355 0.598 . . . . 53.55 111.194 -179.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.585 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 5.8 tmmm? -129.6 107.78 9.71 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.95 -1.023 . . . . 73.31 108.517 173.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.93 35.28 26.16 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.036 -0.529 . . . . 74.24 111.328 -176.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 95.96 -20.91 47.85 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.952 -0.642 . . . . 75.21 112.735 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 62.1 t -85.02 122.84 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 110.225 -0.287 . . . . 74.55 110.225 -177.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -69.06 132.18 46.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.344 -0.389 . . . . 75.41 110.651 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 79.9 mt -87.11 104.72 16.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.83 -0.623 . . . . 51.23 110.07 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 9.7 t -69.64 160.94 30.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.304 0.573 . . . . 63.42 111.206 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . 0.606 ' HA ' HG23 ' A' ' 498' ' ' THR . 0.0 OUTLIER -117.84 -3.45 11.21 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.624 -0.717 . . . . 75.3 109.5 179.689 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -60.82 -39.18 88.01 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.253 -0.885 . . . . 61.14 110.397 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . 0.423 ' O ' ' HG3' ' A' ' 497' ' ' GLU . 8.1 pt-20 -127.55 108.26 10.64 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.101 -0.704 . . . . 62.2 109.101 167.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.606 HG23 ' HA ' ' A' ' 495' ' ' ARG . 0.7 OUTLIER -122.29 88.0 2.85 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.389 0.614 . . . . 64.5 111.235 -176.593 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -100.91 -27.4 13.33 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.42 -0.809 . . . . 62.14 109.078 175.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -95.43 -47.32 6.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.208 -0.906 . . . . 65.33 111.026 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.455 ' O ' ' HD2' ' A' ' 502' ' ' ARG . 13.8 m-85 -103.21 148.41 25.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.2 -0.455 . . . . 74.31 110.622 -176.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 502' ' ' ARG . . . . . 0.455 ' HD2' ' O ' ' A' ' 501' ' ' TYR . 1.5 mpt_? -132.58 137.69 47.17 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.558 -0.534 . . . . 75.33 109.558 171.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -111.94 118.55 35.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.654 0.264 . . . . 72.15 110.799 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 1.4 mptm? -111.83 145.37 39.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.68 0.276 . . . . 72.13 110.354 176.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -123.35 117.57 25.52 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.318 -0.401 . . . . 62.41 110.787 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . 0.472 ' HB2' ' HG3' ' A' ' 509' ' ' ARG . 42.2 m-20 -121.27 77.7 1.35 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.631 -0.507 . . . . 73.23 109.631 173.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 64.84 -109.26 2.75 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.648 -0.786 . . . . 43.41 112.034 -178.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -85.91 -24.66 26.52 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.769 -0.254 . . . . 71.01 111.091 -177.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.608 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 29.6 ptt180 -92.95 132.41 37.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.616 0.722 . . . . 54.21 110.93 -177.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -114.94 143.98 44.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.519 -0.764 . . . . 72.44 109.28 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 25.6 m-70 -119.22 127.62 53.44 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.844 -0.343 . . . . 71.14 110.803 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.412 HD11 ' HB3' ' A' ' 501' ' ' TYR . 65.4 tp -107.03 102.94 12.25 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.363 -0.977 . . . . 70.42 108.363 168.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.625 HD13 ' HG2' ' A' ' 472' ' ' GLU . 5.8 tp -103.47 115.46 45.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.518 0.675 . . . . 63.2 110.242 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.52 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 34.0 mt -95.27 112.74 28.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.631 -0.713 . . . . 53.21 109.221 177.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -73.76 -43.12 59.97 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.076 0.465 . . . . 73.34 110.048 -176.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -128.67 108.54 10.57 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.548 -0.751 . . . . 73.21 109.519 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.403 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -91.48 138.23 31.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.109 -0.496 . . . . 53.14 110.25 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 26.5 mmt -118.84 175.18 5.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.203 -0.453 . . . . 61.21 110.012 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.414 HD22 ' H ' ' A' ' 519' ' ' LEU . 3.0 mm? -64.99 -53.91 38.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.34 -0.391 . . . . 64.34 111.089 -173.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -80.01 -18.5 50.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.128 0.49 . . . . 73.11 110.716 -178.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.29 -33.34 71.45 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.048 -0.524 . . . . 64.25 111.755 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.554 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -64.4 -44.5 91.08 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.865 0.32 . . . . 71.11 111.865 -175.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . 0.585 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 40.47 -157.55 0.03 OUTLIER Glycine 0 CA--C 1.525 0.673 0 O-C-N 123.911 0.757 . . . . 43.22 114.818 175.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 53.7 m80 -105.88 112.45 25.51 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.471 -0.937 . . . . 72.42 108.471 169.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -85.45 131.45 34.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.259 0.552 . . . . 71.44 111.262 -175.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.28 131.42 34.4 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.301 -0.863 . . . . 75.12 110.558 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.6 HD11 ' HB ' ' A' ' 484' ' ' VAL . 37.3 tp -99.62 115.16 28.77 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.438 -0.578 . . . . 74.23 109.438 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 485' ' ' LYS . 48.4 t -100.16 112.87 25.2 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.702 -0.481 . . . . 74.33 109.702 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.522 ' C ' ' H ' ' A' ' 531' ' ' GLY . 61.2 p -111.51 -165.0 0.95 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.886 -0.597 . . . . 70.3 110.625 -178.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 11.9 m -51.09 6.06 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.611 1.164 . . . . 73.5 113.961 171.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . 0.522 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.42 28.88 1.54 Allowed Glycine 0 C--N 1.332 0.348 0 O-C-N 121.952 -0.467 . . . . 53.34 113.253 -175.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -113.4 141.76 17.1 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 109.974 -1.25 . . . . 74.32 109.974 167.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.4 tp60 -128.84 121.96 29.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.461 0.63 . . . . 63.11 112.096 -173.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -131.14 132.16 44.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.581 -0.736 . . . . 55.13 109.274 170.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -118.81 124.38 47.05 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.032 -0.358 . . . . 61.11 110.032 -176.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.694 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -118.69 159.13 24.2 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.136 -0.484 . . . . 52.31 110.215 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -127.36 123.12 35.51 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.92 0.391 . . . . 72.13 110.815 -176.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 464' ' ' LEU . 54.8 tp -112.12 121.48 45.08 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.878 -0.601 . . . . 75.22 109.723 176.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.658 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.5 mp -108.26 107.66 23.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 109.016 -0.735 . . . . 74.54 109.016 176.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 465' ' ' VAL . 42.2 t -94.79 122.82 46.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.32 0.581 . . . . 74.32 110.37 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . 0.474 ' HB3' ' HE3' ' A' ' 543' ' ' LYS . 7.5 mt-30 -114.64 160.54 19.21 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.98 -1.009 . . . . 74.31 110.166 -176.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . 0.419 ' HG2' HG21 ' A' ' 467' ' ' VAL . 46.6 mt-10 -105.95 106.76 17.42 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.949 -0.76 . . . . 64.44 108.949 174.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . 0.474 ' HE3' ' HB3' ' A' ' 541' ' ' GLN . 17.2 ptpt . . . . . 0 C--O 1.245 0.854 0 CA-C-N 116.293 -0.412 . . . . 42.34 110.137 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo . . . . . 0 N--CA 1.454 -0.83 0 N-CA-C 109.656 -0.94 . . . . 74.41 109.656 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.538 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 55.1 t -68.52 106.69 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 120.889 0.376 . . . . 53.34 110.158 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 52.6 tp -87.64 138.75 31.2 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.943 -0.571 . . . . 73.4 110.348 -178.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.479 HD13 HD23 ' A' ' 527' ' ' LEU . 32.7 mt -91.75 113.3 26.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.563 -0.744 . . . . 71.23 109.458 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . 0.453 ' OG1' ' HB2' ' A' ' 476' ' ' GLU . 28.6 p -77.29 -45.86 24.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.929 0.395 . . . . 74.03 110.808 -176.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.46 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 12.1 tpt180 -92.1 111.03 48.09 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.994 -0.548 . . . . 61.33 109.857 176.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -68.81 149.67 73.01 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.491 2.127 . . . . 65.14 111.109 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.781 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 4.0 mm? -66.2 158.94 27.51 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.316 -0.402 . . . . 75.42 110.792 -178.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . 0.528 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 1.8 mp0 -65.12 144.41 57.25 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.97 0.891 . . . . 44.25 112.709 -172.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -104.77 9.13 35.07 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.049 -1.432 . . . . 74.33 111.729 -174.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . 0.505 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -121.44 154.36 36.65 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 122.214 1.006 . . . . 73.41 112.894 -160.256 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.494 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.1 pt? -90.86 147.08 23.41 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 113.4 -1.727 . . . . 64.31 112.206 -167.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.556 HG23 HG22 ' A' ' 540' ' ' VAL . 27.4 m -126.68 178.0 4.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.45 -0.795 . . . . 71.42 110.076 175.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . 0.405 ' HB3' ' HG3' ' A' ' 543' ' ' LYS . 51.4 mtm -118.16 158.65 24.69 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.245 -0.434 . . . . 64.25 110.82 -178.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 51.4 t -50.95 128.6 8.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.653 -0.703 . . . . 72.12 111.72 -176.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 89.39 -16.04 57.06 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 115.838 -0.619 . . . . 72.05 113.337 174.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -83.17 135.09 34.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 117.038 0.419 . . . . 74.55 110.792 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . 0.538 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 2.0 ptm180 -66.33 126.52 29.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.63 -0.714 . . . . 70.3 110.61 175.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.506 ' HB ' HG11 ' A' ' 465' ' ' VAL . 5.2 p -113.16 137.94 44.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.749 -0.463 . . . . 72.34 109.749 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.467 ' HB2' ' NH2' ' A' ' 470' ' ' ARG . 30.4 tt0 -120.49 124.02 44.39 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.785 -0.643 . . . . 72.32 110.515 -173.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.528 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 97.4 m-85 -110.28 141.07 43.78 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.905 -0.589 . . . . 71.13 109.557 176.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -119.2 134.97 54.9 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.903 0.382 . . . . 73.01 110.234 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 27.1 p -146.93 126.55 13.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.368 -0.378 . . . . 61.22 110.392 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.46 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 31.4 mt-10 -110.77 137.66 48.14 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.82 -0.807 . . . . 75.03 108.82 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 508' ' ' GLN . 27.8 m -119.48 152.63 22.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 C-N-CA 120.562 -0.455 . . . . 71.43 110.653 177.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 16.1 m -66.68 -26.04 66.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.66 -0.7 . . . . 61.45 111.718 -175.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . 0.423 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 37.8 tt0 -106.42 118.18 35.98 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.865 -0.42 . . . . 70.53 109.865 -178.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . 0.826 ' HB3' ' HG2' ' A' ' 508' ' ' GLN . 10.0 pt-20 -76.19 134.34 39.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.093 0.473 . . . . 73.45 110.893 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 72.68 21.18 79.78 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.696 -0.684 . . . . 63.5 112.092 -176.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.423 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -73.28 150.84 41.64 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.88 0.372 . . . . 74.3 111.452 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -81.72 114.53 20.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.551 -0.75 . . . . 52.02 110.438 178.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.582 HG12 HG22 ' A' ' 529' ' ' THR . 21.2 m -125.84 150.64 31.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 70.45 109.862 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . 0.508 ' HE2' HD11 ' A' ' 487' ' ' LEU . 21.0 ptmt -125.61 140.44 52.73 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.065 0.459 . . . . 74.23 110.749 177.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -102.01 125.78 48.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.621 -0.718 . . . . 72.22 110.222 -179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . 0.508 HD11 ' HE2' ' A' ' 485' ' ' LYS . 5.7 mp -114.13 136.4 52.98 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.063 -0.517 . . . . 55.01 110.379 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.15 105.46 12.62 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.813 -1.181 . . . . 72.14 107.813 174.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 57.12 34.04 24.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.993 -0.549 . . . . 64.45 110.691 -174.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.25 -18.88 56.65 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.001 -0.619 . . . . 44.34 112.906 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 45.5 t -83.09 127.45 39.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 110.328 -0.249 . . . . 50.13 110.328 -178.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -72.24 126.56 30.12 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.47 -0.567 . . . . 73.41 109.47 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.472 HD11 ' HE2' ' A' ' 525' ' ' TYR . 77.3 mt -66.04 106.43 1.61 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.141 0.496 . . . . 74.22 110.641 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 9.8 t -73.45 141.52 46.87 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 115.586 -0.734 . . . . 74.25 110.751 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . 0.466 ' N ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -107.7 13.12 26.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.694 -0.685 . . . . 73.13 110.264 -179.04 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -59.96 -56.61 19.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.8 -0.637 . . . . 60.34 109.644 174.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -137.78 118.39 13.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.729 -0.668 . . . . 75.4 109.913 173.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.2 108.56 5.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.076 -0.511 . . . . 72.21 110.42 -178.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -104.47 -22.22 13.33 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.284 0.564 . . . . 74.23 110.098 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -92.87 -34.47 13.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.744 -0.662 . . . . 73.11 111.611 -177.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.412 ' HD1' HG12 ' A' ' 514' ' ' ILE . 8.0 m-85 -115.77 141.51 48.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.617 -0.265 . . . . 73.03 110.309 -174.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -132.52 126.42 32.86 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.87 0.366 . . . . 74.21 110.128 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -96.43 113.63 25.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.803 -0.635 . . . . 71.31 110.819 -174.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 42.1 mttm -109.64 124.41 51.13 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.101 -0.5 . . . . 60.03 111.246 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -103.92 111.15 23.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.022 -0.535 . . . . 75.31 109.984 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . 0.401 ' O ' ' HG2' ' A' ' 509' ' ' ARG . 4.9 m-20 -120.03 87.09 2.68 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.124 0.488 . . . . 72.51 110.2 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 63.4 -105.51 1.08 Allowed Glycine 0 N--CA 1.449 -0.448 0 CA-C-N 115.638 -0.71 . . . . 71.42 112.843 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.826 ' HG2' ' HB3' ' A' ' 480' ' ' GLU . 18.5 mt-30 -93.1 -25.18 18.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.767 0.318 . . . . 65.1 110.871 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.401 ' HG2' ' O ' ' A' ' 506' ' ' ASP . 16.9 ptp180 -96.43 153.4 17.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.352 0.596 . . . . 73.23 111.002 -175.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -127.1 123.06 35.98 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.72 -0.673 . . . . 64.31 109.268 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 56.3 m-70 -101.52 118.3 36.67 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.989 -0.374 . . . . 71.21 109.989 -177.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 61.5 tp -104.29 106.69 17.28 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.265 -0.642 . . . . 74.43 109.265 173.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 9.2 tp -104.92 128.77 58.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.992 -0.549 . . . . 75.14 110.133 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 34.2 mt -104.54 114.3 43.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.204 -0.665 . . . . 53.25 109.204 175.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -58.23 -52.64 64.74 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.547 0.529 . . . . 44.51 111.435 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -137.74 109.64 7.17 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.722 -0.473 . . . . 73.35 109.722 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -76.19 127.38 32.8 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.953 -0.567 . . . . 71.02 111.238 -178.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 14.9 mmt -97.51 175.43 6.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.836 -0.62 . . . . 60.15 109.678 176.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.2 -53.36 25.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.952 0.406 . . . . 72.35 110.805 -178.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -71.32 -27.89 63.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.072 -0.513 . . . . 73.11 111.034 -177.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -77.83 -3.44 41.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.516 -0.766 . . . . 52.32 111.857 -173.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.55 ' HA ' HD23 ' A' ' 538' ' ' LEU . . . -74.37 -43.2 57.54 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.498 -0.481 . . . . 52.5 109.918 177.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 38.28 -158.55 0.01 OUTLIER Glycine 0 C--N 1.339 0.734 0 O-C-N 124.457 1.098 . . . . 44.3 115.557 172.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -114.05 108.86 17.57 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.307 -0.627 . . . . 73.52 109.307 169.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . 0.472 ' HE2' HD11 ' A' ' 493' ' ' LEU . 32.1 m-85 -85.63 133.86 34.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.964 0.411 . . . . 73.41 111.087 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -134.35 128.78 34.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.924 -0.58 . . . . 64.44 110.545 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.479 HD23 HD13 ' A' ' 456' ' ' ILE . 63.4 tp -99.86 111.98 24.27 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.84 -0.43 . . . . 73.52 109.84 176.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 70.8 m -104.79 126.08 51.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.299 0.571 . . . . 55.25 110.914 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.582 HG22 HG12 ' A' ' 484' ' ' VAL . 30.1 p -115.79 -165.52 1.05 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.341 -0.845 . . . . 72.41 110.119 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . 0.466 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 14.7 m -50.77 7.43 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.859 1.264 . . . . 73.32 114.173 171.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . 0.535 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 122.14 28.18 1.55 Allowed Glycine 0 C--N 1.331 0.266 0 O-C-N 122.007 -0.433 . . . . 54.33 113.245 -174.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -117.76 138.37 13.96 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.603 -1.399 . . . . 12.41 109.603 163.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -129.35 127.92 42.04 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 117.463 0.632 . . . . 73.31 112.103 -171.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -136.62 136.45 39.18 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.485 -0.78 . . . . 74.11 109.551 171.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 33.3 tp -109.09 145.24 36.0 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.817 0.341 . . . . 62.21 111.029 -176.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.781 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -123.72 132.46 53.82 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.092 -0.504 . . . . 71.44 110.324 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -110.41 115.92 30.51 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.77 -0.456 . . . . 71.34 109.77 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.555 HD11 HG22 ' A' ' 465' ' ' VAL . 35.7 tp -108.64 121.07 44.25 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.058 -0.519 . . . . 75.11 109.723 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 539' ' ' ILE . 4.5 mp -109.98 116.64 52.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.228 -0.656 . . . . 73.13 109.228 177.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.556 HG22 HG23 ' A' ' 465' ' ' VAL . 90.1 t -114.1 128.44 71.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.92 0.391 . . . . 72.02 110.257 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.46 169.65 14.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.048 -0.524 . . . . 62.34 109.894 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.53 141.31 39.67 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.532 -0.758 . . . . 72.32 110.642 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . 0.449 ' HE3' ' HB2' ' A' ' 543' ' ' LYS . 33.2 mtmt . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.398 -0.811 . . . . 72.2 110.033 176.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo . . . . . 0 N--CA 1.448 -1.205 0 N-CA-C 110.391 -0.657 . . . . 73.11 110.391 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.554 ' HB ' ' HB ' ' A' ' 529' ' ' THR . 58.5 t -78.18 107.35 10.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 108.979 -0.749 . . . . 62.12 108.979 178.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 477' ' ' VAL . 62.0 tp -84.91 124.17 31.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.733 -0.667 . . . . 73.32 110.753 -173.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.524 HD13 HD23 ' A' ' 527' ' ' LEU . 29.3 mt -91.01 98.9 8.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.71 -0.677 . . . . 72.42 109.998 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 33.8 p -79.19 -16.04 57.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 72.44 111.088 -176.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.474 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 19.2 tpt85 -130.38 102.03 17.21 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.904 -0.589 . . . . 72.44 109.717 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 458' ' ' ARG . 29.7 Cg_endo -63.62 167.73 12.89 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 123.224 2.616 . . . . 74.4 112.078 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.799 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 3.2 mm? -71.1 172.59 8.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.077 -0.51 . . . . 73.41 110.906 -177.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . 0.906 ' HG2' ' HA ' ' A' ' 473' ' ' PHE . 13.5 mm-40 -67.78 152.8 45.0 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.787 -0.642 . . . . 71.33 112.488 -176.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -105.53 6.51 32.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.315 -0.857 . . . . 70.43 112.454 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . 0.402 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -123.7 154.53 39.29 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.89 0.852 . . . . 71.44 113.008 -162.133 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.653 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.0 pt? -103.9 146.84 28.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.185 -1.37 . . . . 74.52 111.808 -170.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.567 HG11 ' HB ' ' A' ' 471' ' ' VAL . 27.5 m -123.71 178.87 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-O 121.079 0.466 . . . . 44.31 111.265 -177.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 10.4 mtm -112.32 161.61 16.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.377 -0.374 . . . . 65.4 111.295 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . 0.48 HG21 ' HG2' ' A' ' 542' ' ' GLU . 59.6 t -56.72 129.67 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 115.955 -0.566 . . . . 52.35 112.178 -176.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 86.12 7.7 79.86 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.72 -0.673 . . . . 75.41 113.208 174.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -116.73 133.01 56.53 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.799 0.299 . . . . 63.35 110.306 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . 0.579 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 5.3 ptm180 -74.02 131.86 41.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.301 0.572 . . . . 72.5 112.1 -175.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.567 ' HB ' HG11 ' A' ' 465' ' ' VAL . 7.5 p -115.37 146.33 19.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.205 -0.907 . . . . 71.55 109.714 176.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -123.03 129.17 51.16 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.381 -0.229 . . . . 75.12 110.381 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.906 ' HA ' ' HG2' ' A' ' 461' ' ' GLU . 96.0 m-85 -106.45 124.89 50.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.437 -0.579 . . . . 74.45 109.437 174.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -100.25 131.48 46.16 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.085 -0.339 . . . . 73.03 110.085 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.452 ' HB3' HD13 ' A' ' 460' ' ' LEU . 18.2 p -141.4 118.05 10.98 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.091 0.472 . . . . 45.42 110.555 177.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.637 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 39.7 mt-10 -107.39 138.58 43.33 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.853 -0.612 . . . . 71.42 109.747 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 455' ' ' LEU . 28.2 m -132.57 174.06 13.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.297 -0.411 . . . . 71.12 110.767 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 16.7 p -85.77 8.37 20.2 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.482 0.549 . . . . 74.3 112.482 -175.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . 0.56 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 41.2 tt0 -126.82 134.83 50.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.6 0.238 . . . . 64.31 110.631 -177.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . 0.512 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 0.4 OUTLIER -81.83 128.27 33.85 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.555 -0.535 . . . . 73.23 109.555 179.15 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 60.27 32.79 77.89 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.165 -1.017 . . . . 62.55 110.879 -171.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.56 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -50.71 141.67 12.5 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 113.145 0.794 . . . . 75.51 113.145 -174.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -74.79 103.7 5.14 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.126 -0.943 . . . . 73.3 109.813 175.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.559 ' HB ' HD11 ' A' ' 527' ' ' LEU . 34.3 m -121.51 150.11 24.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.931 -0.577 . . . . 73.22 110.836 -177.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 47.1 tttp -123.27 126.86 47.7 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.213 -0.662 . . . . 73.21 109.213 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . 0.461 ' HB3' HD12 ' A' ' 493' ' ' LEU . 95.3 m95 -101.39 125.29 48.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.605 -0.27 . . . . 62.12 110.638 -177.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . 0.441 HD13 ' SG ' ' A' ' 528' ' ' CYS . 6.5 mp -128.12 144.07 51.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.065 0.459 . . . . 75.41 110.77 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.481 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 5.8 tmmm? -124.19 106.78 10.58 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.363 -0.977 . . . . 65.14 108.363 174.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 52.21 36.01 18.23 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.749 0.656 . . . . 73.24 111.693 -175.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.02 -20.07 51.73 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.869 -0.681 . . . . 34.01 112.921 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 43.4 t -86.64 123.79 39.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 110.092 -0.336 . . . . 63.44 110.092 -179.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -70.6 134.28 47.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.094 0.473 . . . . 70.03 110.804 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.461 HD12 ' HB3' ' A' ' 486' ' ' TRP . 52.2 mt -82.73 103.22 12.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.767 -0.651 . . . . 74.52 109.411 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 7.0 t -65.15 145.52 56.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 73.1 111.631 -177.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.62 9.5 17.88 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.149 -0.932 . . . . 70.22 109.482 176.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.32 -44.41 16.24 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.723 -0.671 . . . . 72.2 110.04 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 497' ' ' GLU . 7.0 pt-20 -143.16 110.08 5.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.314 0.578 . . . . 73.33 109.573 171.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.544 HG21 ' HB2' ' A' ' 501' ' ' TYR . 0.3 OUTLIER -142.76 109.54 5.47 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.231 0.539 . . . . 61.35 111.381 -177.072 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -89.88 -7.54 53.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.616 -0.72 . . . . 72.02 110.871 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . 0.414 ' CG ' ' HB2' ' A' ' 516' ' ' GLU . 3.4 mtmm -114.4 -48.75 2.86 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.048 -0.524 . . . . 64.44 112.054 -173.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.544 ' HB2' HG21 ' A' ' 498' ' ' THR . 57.2 m-85 -93.04 126.77 38.29 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.813 -0.44 . . . . 72.43 109.813 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 502' ' ' ARG . . . . . 0.466 ' HA ' ' HD2' ' A' ' 502' ' ' ARG . 1.2 tpt180 -117.09 123.11 45.99 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.234 -0.654 . . . . 63.24 109.234 177.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -104.13 117.46 34.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.236 -0.438 . . . . 64.5 110.228 -174.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 57.2 mttm -114.35 131.56 56.51 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.35 -0.386 . . . . 54.02 110.576 -178.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -103.9 118.27 36.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.196 -0.456 . . . . 73.14 110.687 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -120.42 89.92 3.22 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.104 -0.498 . . . . 62.45 110.016 174.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 61.68 -101.45 0.35 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.637 -0.71 . . . . 74.52 112.518 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.512 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 26.5 mt-30 -98.88 -20.23 16.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.524 0.202 . . . . 74.52 111.376 -177.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.637 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 14.7 ptt180 -101.04 153.54 19.46 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.333 0.587 . . . . 73.45 111.585 -175.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -121.99 141.37 51.41 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.424 -0.807 . . . . 75.53 109.494 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 15.3 m-70 -110.6 133.26 53.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 110.02 -0.363 . . . . 64.02 110.02 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 66.6 tp -107.51 104.19 13.69 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.739 -0.467 . . . . 64.32 109.739 172.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.483 HD13 ' HD2' ' A' ' 504' ' ' LYS . 1.9 mp -100.91 127.7 53.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.065 -0.516 . . . . 53.33 110.092 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.579 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 53.7 mt -108.1 112.37 39.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.743 -0.466 . . . . 73.33 109.743 174.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -72.44 -44.45 62.37 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.195 -0.457 . . . . 45.43 111.144 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . 0.414 ' HB2' ' CG ' ' A' ' 500' ' ' LYS . 31.8 mt-10 -116.2 107.52 14.99 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.591 -0.522 . . . . 60.33 109.591 -178.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -94.2 113.21 25.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.383 -0.371 . . . . 61.45 110.47 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . 0.453 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 25.0 mmt -110.7 164.8 12.39 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.166 -0.47 . . . . 62.44 110.281 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.541 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.1 mm? -61.37 -55.41 31.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 72.05 111.529 -172.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -82.99 -8.04 59.6 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.104 -0.498 . . . . 74.24 111.528 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 9.2 t70 -82.28 -27.26 32.48 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.312 -0.404 . . . . 70.11 110.521 -175.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.677 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -63.27 -41.73 99.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 73.4 111.614 -177.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . 0.481 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 42.48 -158.2 0.07 OUTLIER Glycine 0 CA--C 1.526 0.742 0 O-C-N 123.783 0.677 . . . . 51.3 114.422 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -109.6 115.69 30.36 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.007 -0.738 . . . . 65.14 109.007 172.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -89.48 131.67 35.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.349 0.595 . . . . 73.35 111.145 -176.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.94 125.48 33.55 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.434 -0.803 . . . . 71.53 110.186 178.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.559 HD11 ' HB ' ' A' ' 484' ' ' VAL . 44.6 tp -92.55 112.32 24.23 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.478 -0.564 . . . . 51.33 109.478 177.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . 0.441 ' SG ' HD13 ' A' ' 487' ' ' LEU . 62.2 m -107.42 114.89 29.2 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.882 -0.599 . . . . 74.02 110.321 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.571 ' C ' ' H ' ' A' ' 531' ' ' GLY . 72.2 p -109.89 -165.39 1.0 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.054 -0.521 . . . . 73.23 109.874 178.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . 0.464 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 20.3 m -48.6 6.65 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.742 1.217 . . . . 64.25 114.18 171.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . 0.571 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.44 26.62 1.95 Allowed Glycine 0 N--CA 1.451 -0.356 0 O-C-N 122.092 -0.38 . . . . 63.2 112.949 -176.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -110.45 144.38 17.08 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 109.406 -1.477 . . . . 64.24 109.406 163.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.58 132.39 48.21 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 117.83 0.815 . . . . 73.15 111.613 -171.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -141.12 128.59 21.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.697 -0.683 . . . . 62.35 109.451 172.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.425 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.7 tm? -114.8 131.95 56.64 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 110.101 -0.333 . . . . 62.55 110.101 -174.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.799 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -128.95 158.17 39.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.53 -0.305 . . . . 71.04 110.583 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -131.9 117.49 18.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.533 -0.303 . . . . 54.43 110.19 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.513 HD11 HG22 ' A' ' 465' ' ' VAL . 37.3 tp -106.1 128.71 54.07 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.979 -0.555 . . . . 74.2 109.831 178.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.653 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.3 mp -117.89 108.7 25.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 109.365 -0.605 . . . . 64.43 109.365 177.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.677 HG23 ' HB2' ' A' ' 522' ' ' ALA . 66.9 t -90.64 132.37 35.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.784 -0.45 . . . . 51.44 109.784 178.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -120.89 157.9 28.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.815 -0.63 . . . . 73.23 110.333 -175.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . 0.541 ' HG3' HD11 ' A' ' 519' ' ' LEU . 39.0 mt-10 -107.9 117.77 35.0 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.967 -0.561 . . . . 64.32 110.38 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . 0.877 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 9.6 mmpt? . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.31 -0.852 . . . . 52.43 109.58 171.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo . . . . . 0 N--CA 1.456 -0.721 0 N-CA-C 111.136 -0.371 . . . . 71.23 111.136 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.476 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 83.0 t -67.08 111.51 2.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.064 0.459 . . . . 71.1 110.065 178.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 60.1 tp -91.22 148.63 22.22 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.498 -0.773 . . . . 62.4 110.344 -176.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.541 HD13 HD23 ' A' ' 527' ' ' LEU . 25.2 mt -94.79 99.52 9.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.232 -0.655 . . . . 65.3 109.232 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 12.5 p -70.02 -34.51 73.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.006 -0.543 . . . . 73.33 110.904 -176.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 458' ' ' ARG . 3.1 tpp180 -116.77 105.52 49.6 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 116.03 -0.532 . . . . 72.24 109.937 174.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -66.55 168.86 15.45 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.193 2.595 . . . . 74.12 111.254 175.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.67 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 2.5 mm? -65.0 153.59 40.22 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.811 -0.44 . . . . 62.3 109.811 -178.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . 0.434 ' HB3' HE22 ' A' ' 463' ' ' GLN . 2.6 tp10 -66.37 152.99 43.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.412 0.625 . . . . 71.44 111.652 -170.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -92.02 9.01 35.03 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.816 1.043 . . . . 73.31 113.816 -167.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . 0.434 HE22 ' HB3' ' A' ' 461' ' ' GLU . 0.0 OUTLIER -123.13 153.86 39.41 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.572 -0.851 . . . . 75.22 112.109 -166.37 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.72 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.3 pt? -118.02 144.9 45.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.291 -1.322 . . . . 62.13 110.798 -170.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.401 HG11 ' HB ' ' A' ' 471' ' ' VAL . 31.2 m -117.71 177.64 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.225 0.536 . . . . 61.52 112.131 -174.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.81 171.12 9.07 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.543 -0.753 . . . . 50.51 110.707 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . 0.553 HG21 ' HG2' ' A' ' 542' ' ' GLU . 46.8 t -59.67 125.81 16.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.211 -0.449 . . . . 51.11 111.32 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 81.96 3.4 90.59 Favored Glycine 0 CA--C 1.517 0.201 0 CA-C-N 115.889 -0.596 . . . . 63.1 113.065 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -96.01 136.99 35.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.752 0.311 . . . . 74.14 110.608 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 1.5 ptm180 -66.84 146.69 54.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.824 -0.625 . . . . 74.32 111.377 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.401 ' HB ' HG11 ' A' ' 465' ' ' VAL . 7.7 p -147.38 137.94 17.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.579 -0.737 . . . . 72.22 109.643 175.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.52 ' HG3' HG13 ' A' ' 513' ' ' ILE . 13.0 mp0 -107.68 130.96 54.88 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.871 0.367 . . . . 63.32 110.559 178.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.588 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 57.8 m-85 -108.07 113.21 26.2 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.574 -0.528 . . . . 72.33 109.574 170.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -95.81 132.45 41.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.649 -0.705 . . . . 62.2 110.388 -176.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 458' ' ' ARG . 7.0 p -141.29 118.54 11.38 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.875 0.369 . . . . 73.2 110.613 177.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.993 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 23.4 mt-10 -112.16 138.24 49.12 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.527 -0.545 . . . . 62.44 109.527 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.492 HG21 ' HB3' ' A' ' 482' ' ' ALA . 26.2 m -122.6 173.12 8.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.578 -0.283 . . . . 64.4 111.304 -178.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 15.4 m -61.61 -36.27 80.26 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.152 0.797 . . . . 41.34 113.152 -175.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -119.72 156.25 30.89 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.421 -0.215 . . . . 72.1 110.421 -172.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . 0.483 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 0.1 OUTLIER -86.34 143.72 27.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.095 0.474 . . . . 62.43 110.563 -179.005 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 72.62 3.38 58.57 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.821 -0.704 . . . . 71.33 112.733 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.492 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -56.07 134.38 52.59 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.845 0.355 . . . . 73.43 110.959 -179.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -78.09 139.3 39.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.748 -0.66 . . . . 44.13 110.058 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.6 ' HB ' HD11 ' A' ' 527' ' ' LEU . 20.1 m -127.44 150.58 33.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.049 0.452 . . . . 72.3 110.875 -178.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . 0.552 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 65.4 tttp -108.2 122.09 46.2 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.608 -0.724 . . . . 73.32 109.378 179.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . 0.54 ' HB3' HD12 ' A' ' 493' ' ' LEU . 59.1 m95 -101.34 122.22 43.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.945 0.403 . . . . 75.32 110.623 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . 0.456 HD11 ' HE3' ' A' ' 485' ' ' LYS . 86.0 mt -130.15 139.08 50.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.865 -0.607 . . . . 63.04 111.34 -176.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.628 ' O ' HG12 ' A' ' 491' ' ' VAL . 3.7 tmmm? -115.3 106.52 14.13 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.085 -1.08 . . . . 73.31 108.085 168.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 51.79 34.37 13.06 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.162 -0.472 . . . . 63.03 111.253 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.42 -14.57 60.78 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.807 -0.711 . . . . 44.32 114.015 175.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . 0.628 HG12 ' O ' ' A' ' 488' ' ' LYS . 6.2 p -87.89 139.72 16.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-N 117.862 0.831 . . . . 51.03 110.559 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -66.59 124.18 22.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.986 -0.552 . . . . 75.2 111.567 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.54 HD12 ' HB3' ' A' ' 486' ' ' TRP . 94.1 mt -84.15 106.81 16.08 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.921 -0.77 . . . . 73.35 108.921 171.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 5.5 t -64.39 129.09 38.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.331 0.586 . . . . 74.43 111.656 -174.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.16 3.01 18.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.587 -0.733 . . . . 73.13 110.455 176.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -59.6 -54.27 48.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.099 -0.5 . . . . 72.02 109.954 173.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -149.34 111.62 4.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.609 -0.723 . . . . 53.45 109.833 174.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.448 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.2 OUTLIER -124.6 125.83 44.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.061 -0.518 . . . . 71.3 110.229 -178.119 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -94.81 -42.08 8.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.452 0.644 . . . . 73.4 110.17 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -80.17 -44.25 20.17 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.318 -0.856 . . . . 65.13 110.895 -173.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.448 ' O ' ' HB ' ' A' ' 498' ' ' THR . 5.1 m-85 -104.95 141.82 35.88 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.027 -0.731 . . . . 73.33 109.027 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 21.0 mtp180 -128.26 123.22 33.59 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.111 0.481 . . . . 65.42 109.742 176.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -94.77 127.8 41.03 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.634 -0.712 . . . . 74.32 110.368 -174.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.621 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 1.3 mptm? -114.4 144.85 42.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.421 -0.354 . . . . 54.34 110.679 177.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -116.24 130.35 56.74 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.051 -0.522 . . . . 65.41 109.823 177.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . 0.403 ' HB3' ' HG3' ' A' ' 509' ' ' ARG . 27.7 t70 -138.83 86.83 2.17 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.136 0.493 . . . . 75.2 110.06 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 63.7 -104.28 0.83 Allowed Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.899 -0.591 . . . . 52.11 112.551 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.483 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 21.6 mt-30 -95.43 -15.36 23.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.865 0.365 . . . . 73.51 110.797 -176.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.993 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 5.7 ptt180 -106.93 139.58 41.1 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.507 0.67 . . . . 73.25 111.786 -175.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -114.5 143.85 44.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.179 -0.919 . . . . 72.23 108.71 176.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . 0.621 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 84.6 m-70 -118.14 128.0 54.31 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.339 -0.245 . . . . 74.24 110.339 -177.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.588 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 57.7 tp -104.16 103.86 13.7 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.793 -0.447 . . . . 73.32 109.793 174.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.52 HG13 ' HG3' ' A' ' 472' ' ' GLU . 1.7 mp -98.23 118.93 45.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.025 -0.534 . . . . 74.23 110.217 177.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.48 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 62.2 mt -100.17 113.2 34.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.813 -0.63 . . . . 62.14 109.659 175.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -75.47 -46.98 29.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.102 0.477 . . . . 71.51 110.611 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -121.17 108.33 13.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.727 -0.67 . . . . 71.14 109.629 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.448 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -91.37 117.34 29.58 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.156 -0.475 . . . . 72.42 110.302 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 25.7 mmt -108.14 166.85 10.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.448 -0.342 . . . . 63.32 110.548 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.446 ' H ' HD22 ' A' ' 519' ' ' LEU . 3.3 mm? -57.73 -53.32 59.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 45.3 111.214 -174.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -77.69 -18.04 57.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.818 -0.628 . . . . 60.53 110.975 -175.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -80.17 -21.02 43.49 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.106 -0.497 . . . . 71.11 111.831 -174.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.664 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -63.36 -42.85 98.91 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.966 -0.293 . . . . 55.42 110.892 -177.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.23 -158.66 0.06 OUTLIER Glycine 0 C--N 1.335 0.498 0 CA-C-N 115.282 -0.872 . . . . 42.31 114.02 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 -118.98 108.64 15.0 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.087 -0.709 . . . . 75.41 109.087 170.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . 0.477 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 16.1 m-30 -85.19 132.81 34.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.084 -0.507 . . . . 74.5 111.186 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -134.89 119.25 17.84 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.539 -0.755 . . . . 64.41 109.641 176.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.6 HD11 ' HB ' ' A' ' 484' ' ' VAL . 40.9 tp -89.02 117.95 28.4 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.244 -0.434 . . . . 73.41 110.171 -177.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . 0.552 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 70.0 m -104.45 122.88 46.45 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.975 -0.557 . . . . 72.4 109.976 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.555 HG23 HG12 ' A' ' 484' ' ' VAL . 0.2 OUTLIER -116.54 -167.08 1.23 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.889 -0.596 . . . . 74.32 110.275 -175.724 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . 0.454 ' H ' HG22 ' A' ' 529' ' ' THR . 9.9 m -52.11 7.4 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.418 1.487 . . . . 60.1 114.082 173.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . 0.546 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.14 26.73 1.99 Allowed Glycine 0 N--CA 1.452 -0.293 0 N-CA-C 111.69 -0.564 . . . . 73.12 111.69 -168.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -123.75 142.29 14.17 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 109.168 -1.573 . . . . 71.44 109.168 165.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.29 121.36 20.03 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 117.701 0.751 . . . . 73.21 110.694 -173.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -118.28 139.08 51.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.174 -0.466 . . . . 44.25 110.745 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.411 HD13 ' N ' ' A' ' 536' ' ' ALA . 3.0 tm? -106.61 134.96 48.96 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.568 -0.53 . . . . 72.31 109.568 -177.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.67 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -118.47 152.58 35.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.771 0.32 . . . . 55.51 111.242 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -117.19 116.18 26.77 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.119 -0.492 . . . . 74.32 109.901 175.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.548 HD23 ' HA ' ' A' ' 522' ' ' ALA . 28.1 tp -129.82 115.9 17.92 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.989 0.424 . . . . 64.11 109.878 175.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.479 ' HB ' ' CD1' ' A' ' 464' ' ' LEU . 62.0 mt -126.95 109.05 19.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.333 -0.617 . . . . 73.21 109.333 176.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.664 HG23 ' HB2' ' A' ' 522' ' ' ALA . 79.2 t -89.67 127.83 42.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 N-CA-C 109.284 -0.636 . . . . 50.34 109.284 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -126.65 144.3 50.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.848 -0.615 . . . . 61.14 110.855 -174.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . 0.553 ' HG2' HG21 ' A' ' 467' ' ' VAL . 37.7 mt-10 -89.2 109.95 20.76 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.115 -0.698 . . . . 71.45 109.115 173.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 58.1 pttt . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.539 -0.743 . . . . 73.02 109.961 -178.433 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.448 -1.165 0 N-CA-C 110.214 -0.725 . . . . 54.04 110.214 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.55 ' H ' ' HB2' ' A' ' 530' ' ' SER . 98.2 t -74.86 110.27 9.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.817 -0.438 . . . . 71.35 109.817 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 60.4 tp -79.49 129.95 34.95 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.624 -0.716 . . . . 63.44 110.151 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.501 HD13 HD23 ' A' ' 527' ' ' LEU . 42.3 mt -80.27 98.23 3.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.884 -0.784 . . . . 70.02 108.884 175.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 35.7 p -69.62 -39.45 77.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.627 -0.715 . . . . 64.0 111.382 -172.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.676 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 6.4 tpt180 -102.81 122.46 45.75 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.843 -0.617 . . . . 74.01 110.5 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.43 165.72 23.98 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.87 2.38 . . . . 73.35 112.294 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.542 ' CB ' ' HB2' ' A' ' 536' ' ' ALA . 4.1 mm? -80.26 172.01 14.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.129 -0.487 . . . . 74.41 111.408 -179.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . 0.557 ' HG3' ' OE1' ' A' ' 463' ' ' GLN . 0.3 OUTLIER -69.3 138.31 53.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.495 -0.775 . . . . 72.53 111.561 -175.64 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -104.97 8.56 34.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.983 -1.008 . . . . 70.34 113.321 -169.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . 0.557 ' OE1' ' HG3' ' A' ' 461' ' ' GLU . 0.2 OUTLIER -124.07 152.73 42.34 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 119.54 -0.864 . . . . 72.11 112.151 -168.709 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.585 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.3 pt? -100.4 146.43 27.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.495 -1.23 . . . . 73.52 111.433 -171.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.527 HG11 ' HB ' ' A' ' 471' ' ' VAL . 27.1 m -117.82 177.09 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.04 0.447 . . . . 71.34 110.508 175.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . 0.405 ' HG2' ' HG3' ' A' ' 543' ' ' LYS . 37.7 mtm -118.18 159.77 22.73 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.001 -0.545 . . . . 74.55 110.135 -177.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . 0.512 HG21 ' HG2' ' A' ' 542' ' ' GLU . 64.8 t -55.27 124.33 8.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.004 0.43 . . . . 72.41 111.495 -174.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.41 -11.96 58.31 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.975 -0.631 . . . . 54.44 112.616 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -102.98 145.3 30.08 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.102 -0.333 . . . . 73.12 110.102 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . 0.504 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 5.4 ptp180 -86.76 135.1 33.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.268 0.556 . . . . 73.24 111.649 -177.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.527 ' HB ' HG11 ' A' ' 465' ' ' VAL . 7.1 p -119.1 133.96 64.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.622 -0.717 . . . . 54.23 110.019 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -115.44 127.9 55.66 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.507 -0.315 . . . . 64.11 110.176 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.46 ' HB3' HD12 ' A' ' 460' ' ' LEU . 96.5 m-85 -104.77 115.65 30.67 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.479 -0.563 . . . . 74.14 109.479 177.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.42 133.96 47.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.234 -0.439 . . . . 62.33 110.046 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 509' ' ' ARG . 20.9 p -149.41 147.56 28.42 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.194 -0.457 . . . . 73.34 110.681 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.676 ' HB2' ' HB3' ' A' ' 458' ' ' ARG . 49.1 mt-10 -123.07 138.75 54.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.839 0.352 . . . . 61.35 110.286 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.401 ' O ' ' HB3' ' A' ' 508' ' ' GLN . 18.6 m -113.11 163.3 10.44 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.928 -0.578 . . . . 74.24 109.742 174.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 11.5 t -60.67 -38.35 84.63 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.162 0.43 . . . . 45.13 112.162 -175.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 6.6 tp10 -106.98 139.71 40.94 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.255 -0.276 . . . . 71.54 110.255 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.51 134.98 43.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.261 0.553 . . . . 73.12 111.157 -177.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 63.46 19.74 62.66 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.749 -0.66 . . . . 70.33 112.862 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.553 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -62.1 151.56 35.3 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.93 0.395 . . . . 74.21 111.077 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . 0.482 ' CD ' ' H ' ' A' ' 483' ' ' GLN . 0.0 OUTLIER -72.54 118.89 16.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.451 0.643 . . . . 75.14 110.912 179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.634 HG12 HG23 ' A' ' 529' ' ' THR . 34.9 m -127.34 150.66 33.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.299 -0.864 . . . . 62.12 109.508 178.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . 0.562 ' HE2' ' HG3' ' A' ' 492' ' ' GLU . 83.6 tttt -128.31 136.33 50.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.768 0.318 . . . . 72.12 110.18 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . 0.563 ' HB3' HD12 ' A' ' 493' ' ' LEU . 90.1 m95 -102.15 125.92 48.97 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.971 0.415 . . . . 72.12 110.814 -176.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . 0.533 ' HG ' ' HA ' ' A' ' 492' ' ' GLU . 8.0 mp -126.32 159.53 32.88 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.926 -0.579 . . . . 61.41 110.068 176.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -141.15 116.97 10.39 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.448 -0.575 . . . . 74.33 109.448 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 57.82 34.14 24.04 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.511 0.507 . . . . 65.24 110.614 -175.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 81.98 -10.71 51.67 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.683 -0.689 . . . . 74.0 112.449 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 40.6 t -86.78 129.98 37.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.869 -0.419 . . . . 74.04 109.869 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . 0.562 ' HG3' ' HE2' ' A' ' 485' ' ' LYS . 33.1 tt0 -65.27 131.07 45.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.67 . . . . 65.43 110.259 -179.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.563 HD12 ' HB3' ' A' ' 486' ' ' TRP . 85.6 mt -85.54 118.24 24.93 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.945 -0.391 . . . . 71.22 109.945 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 5.1 t -67.18 145.85 54.82 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.571 -0.741 . . . . 75.1 111.161 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . 0.479 ' H ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -120.44 16.09 12.12 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.14 -0.689 . . . . 75.42 109.14 175.047 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -76.98 -60.97 2.14 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.231 -0.895 . . . . 64.43 109.578 176.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 497' ' ' GLU . 0.8 OUTLIER -105.31 106.56 17.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.286 0.565 . . . . 74.24 109.899 174.595 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.487 HG21 ' HE1' ' A' ' 503' ' ' PHE . 2.8 p -136.73 87.62 2.3 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.392 0.615 . . . . 73.03 111.505 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -105.8 -26.69 11.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.597 -0.729 . . . . 63.1 109.339 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . 0.429 ' HE3' ' CE2' ' A' ' 501' ' ' TYR . 42.2 pttt -94.51 -22.83 17.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.262 -0.881 . . . . 71.52 110.831 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.478 ' O ' ' HB ' ' A' ' 498' ' ' THR . 6.6 m-85 -118.88 133.67 55.68 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.703 -0.48 . . . . 54.12 109.703 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 502' ' ' ARG . . . . . 0.619 ' HB2' ' CG2' ' A' ' 513' ' ' ILE . 33.7 mmt180 -122.99 126.79 47.83 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.902 -0.407 . . . . 74.44 109.902 176.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . 0.487 ' HE1' HG21 ' A' ' 498' ' ' THR . 88.7 m-85 -94.98 113.26 24.95 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.063 -0.347 . . . . 74.25 110.063 178.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.647 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 4.7 mptp? -102.08 119.89 39.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.608 -0.269 . . . . 72.32 111.047 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -102.62 111.91 24.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.261 -0.644 . . . . 53.43 109.261 173.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 509' ' ' ARG . 33.1 t70 -136.28 74.6 1.51 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.299 0.571 . . . . 74.25 110.137 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 82.58 -131.71 10.58 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.804 -0.712 . . . . 51.3 112.055 -178.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.401 ' HB3' ' O ' ' A' ' 477' ' ' VAL . 20.3 mt-30 -79.23 -23.63 43.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.066 0.46 . . . . 52.4 110.397 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 506' ' ' ASP . 18.4 ptt180 -89.48 143.32 26.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.501 -0.772 . . . . 73.11 110.805 -177.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 -130.26 118.96 22.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.826 -0.624 . . . . 61.02 109.492 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . 0.647 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 13.5 m-70 -101.87 122.84 44.76 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.993 -0.283 . . . . 71.4 110.349 -176.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 67.8 tp -105.75 108.51 20.06 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.556 -0.535 . . . . 73.54 109.556 172.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.619 ' CG2' ' HB2' ' A' ' 502' ' ' ARG . 9.8 tp -99.47 124.72 52.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.323 0.582 . . . . 74.11 110.328 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 74.5 mt -104.29 111.7 34.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 108.93 -0.767 . . . . 72.41 108.93 173.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -72.92 -44.04 61.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.132 0.491 . . . . 73.23 110.829 -176.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -131.24 108.85 9.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.815 -0.629 . . . . 75.5 109.885 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.428 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -90.52 131.37 36.3 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.191 -0.459 . . . . 73.22 110.768 -178.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . 0.527 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 10.1 mmt -95.69 167.25 11.4 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.225 -0.443 . . . . 74.01 110.502 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.485 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.7 mm? -62.39 -53.73 50.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.88 0.371 . . . . 74.43 111.593 -176.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -81.57 -12.15 58.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.114 0.483 . . . . 74.35 110.669 -177.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . 0.527 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 29.1 t70 -74.93 -16.41 60.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.713 -0.676 . . . . 74.0 111.057 -175.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.567 ' HB1' ' O ' ' A' ' 538' ' ' LEU . . . -61.42 -41.77 97.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.644 -0.253 . . . . 43.13 110.409 -178.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 40.0 -157.23 0.03 OUTLIER Glycine 0 CA--C 1.522 0.53 0 N-CA-C 116.0 1.16 . . . . 72.5 116.0 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -118.49 107.24 13.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.57 -0.815 . . . . 63.51 109.056 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' A' ' 493' ' ' LEU . 29.0 m-85 -85.94 133.55 33.93 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.069 0.461 . . . . 64.33 111.283 -176.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -135.56 137.75 42.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.769 -0.65 . . . . 72.03 110.558 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.568 HD11 ' HB ' ' A' ' 484' ' ' VAL . 42.1 tp -102.87 110.09 21.89 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.054 -0.521 . . . . 60.34 110.172 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . 0.416 ' SG ' HD13 ' A' ' 487' ' ' LEU . 94.6 m -90.76 117.09 29.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.147 -0.478 . . . . 62.32 110.189 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.634 HG23 HG12 ' A' ' 484' ' ' VAL . 0.2 OUTLIER -115.82 -169.86 1.67 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.88 -0.6 . . . . 43.23 110.275 -177.711 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . 0.55 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 17.3 m -55.57 8.96 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.12 1.368 . . . . 74.22 113.772 173.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . 0.513 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.76 26.88 2.03 Favored Glycine 0 N--CA 1.45 -0.405 0 CA-C-O 121.515 0.508 . . . . 42.21 111.942 -170.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -115.04 144.47 18.45 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 109.608 -1.397 . . . . 61.14 109.608 165.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -132.7 120.74 22.1 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 117.586 0.693 . . . . 72.44 111.405 -174.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -127.44 147.1 50.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.658 -0.701 . . . . 74.01 109.658 173.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.506 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.0 tm? -123.43 137.76 54.74 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.879 -0.415 . . . . 44.11 109.879 -176.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.542 ' HB2' ' CB ' ' A' ' 460' ' ' LEU . . . -132.51 141.05 48.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.439 -0.346 . . . . 71.41 110.324 177.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -121.47 117.21 26.28 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.233 0.539 . . . . 63.3 110.978 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.567 ' O ' ' HB1' ' A' ' 522' ' ' ALA . 46.9 tp -102.01 140.47 36.25 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.284 -0.871 . . . . 73.41 109.162 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.585 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 5.0 mp -125.28 108.62 20.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.536 -0.542 . . . . 41.51 109.536 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.453 HG23 ' HB2' ' A' ' 522' ' ' ALA . 66.7 t -107.13 129.3 61.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.921 0.391 . . . . 74.21 110.647 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.51 150.95 50.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.833 -0.622 . . . . 63.12 109.529 178.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . 0.512 ' HG2' HG21 ' A' ' 467' ' ' VAL . 34.3 mt-10 -73.93 108.75 6.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.059 0.457 . . . . 73.02 110.407 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . 0.405 ' HG3' ' HG2' ' A' ' 466' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 N-CA-C 108.889 -0.782 . . . . 72.45 108.889 179.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo . . . . . 0 N--CA 1.454 -0.816 0 N-CA-C 111.205 -0.344 . . . . 65.22 111.205 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.455 ' H ' ' HB2' ' A' ' 530' ' ' SER . 94.7 t -76.2 107.69 7.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 109.485 -0.561 . . . . 75.2 109.485 178.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 54.6 tp -98.43 133.42 42.84 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.67 -0.695 . . . . 70.52 110.142 -176.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 54.2 mt -74.04 102.84 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 109.242 -0.651 . . . . 74.43 109.242 178.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.25 -13.19 57.42 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.415 -0.812 . . . . 42.53 110.657 -173.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.478 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 18.8 tpp180 -137.95 112.04 8.82 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 116.001 -0.545 . . . . 63.23 109.764 175.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -57.19 166.2 4.57 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.786 2.324 . . . . 70.03 111.669 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.691 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 1.7 mm? -74.3 171.75 13.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.385 -0.371 . . . . 71.34 110.474 -175.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -66.67 148.25 52.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.868 -0.606 . . . . 73.41 111.805 -171.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -105.35 9.94 33.63 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.768 1.025 . . . . 73.22 113.768 -169.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.92 153.18 38.81 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 119.063 -1.055 . . . . 75.35 112.592 -165.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.575 ' H ' HD23 ' A' ' 464' ' ' LEU . 1.9 pt? -94.18 146.9 23.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.008 -1.451 . . . . 73.41 111.353 -173.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.617 HG23 HG22 ' A' ' 540' ' ' VAL . 29.7 m -128.34 177.2 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 73.1 111.682 -175.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -109.31 165.82 11.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 75.05 110.276 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . 0.435 HG12 ' HA ' ' A' ' 518' ' ' MET . 13.9 m -68.08 139.56 20.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.003 0.43 . . . . 62.55 111.263 177.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 78.61 4.03 87.31 Favored Glycine 0 CA--C 1.518 0.268 0 CA-C-N 115.899 -0.591 . . . . 62.35 113.452 175.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -108.21 143.85 36.46 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.848 -0.427 . . . . 52.23 109.848 178.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . 0.6 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 0.0 OUTLIER -66.42 140.4 58.05 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.18 0.514 . . . . 62.45 110.997 -179.134 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.475 HG22 HG21 ' A' ' 465' ' ' VAL . 4.6 t -114.52 133.37 60.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.712 -0.676 . . . . 61.04 109.654 177.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -112.37 119.47 38.37 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.054 0.454 . . . . 75.04 110.467 178.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.493 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 36.6 m-85 -109.46 130.58 55.49 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.524 -0.762 . . . . 63.5 110.635 174.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -109.65 140.55 43.35 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.016 -0.538 . . . . 72.0 110.149 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.639 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 21.9 p -149.47 125.46 10.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.788 0.328 . . . . 63.21 110.872 177.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.478 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 44.8 mt-10 -108.56 140.92 41.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.15 -0.477 . . . . 75.54 109.739 178.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.434 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 27.9 m -130.24 170.6 18.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.61 0.243 . . . . 75.53 110.658 176.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 12.5 p -70.6 -35.3 72.93 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.514 0.561 . . . . 51.22 112.514 -174.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . 0.572 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 39.6 tt0 -101.96 134.14 45.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.72 0.295 . . . . 72.2 110.93 -178.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . 0.607 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 14.0 pt-20 -79.23 132.26 36.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.954 0.407 . . . . 74.44 110.059 176.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . 0.556 ' HA2' ' HD2' ' A' ' 505' ' ' LYS . . . 75.93 12.01 84.28 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.783 -0.723 . . . . 23.35 112.437 -176.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.572 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -60.37 141.58 56.09 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.781 0.324 . . . . 74.31 111.477 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . 0.448 ' H ' ' NE2' ' A' ' 483' ' ' GLN . 0.0 OUTLIER -83.69 118.03 23.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.321 0.581 . . . . 72.23 110.558 -178.415 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 26.3 m -136.12 159.69 38.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.656 -0.702 . . . . 75.52 110.222 -178.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 66.0 pttt -136.0 152.94 51.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.806 0.336 . . . . 71.34 110.497 176.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -102.78 134.0 46.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.094 -0.503 . . . . 72.52 111.359 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . 0.557 HD13 ' SG ' ' A' ' 528' ' ' CYS . 10.7 mp -118.33 136.28 53.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.699 -0.682 . . . . 73.23 109.205 172.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.463 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 3.0 tmmm? -120.66 110.33 16.28 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.878 0.37 . . . . 72.22 110.077 -177.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.5 t70 58.04 35.66 25.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.182 -0.917 . . . . 74.32 110.591 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 92.79 -9.23 75.89 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.673 -0.694 . . . . 61.35 112.88 178.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 46.9 t -101.42 122.95 54.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 110.189 -0.3 . . . . 71.44 110.189 -179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . 0.542 ' HA ' ' HG ' ' A' ' 487' ' ' LEU . 36.0 tt0 -70.99 127.82 33.87 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.097 -0.501 . . . . 65.14 110.232 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.665 HD11 ' HE1' ' A' ' 525' ' ' TYR . 91.7 mt -77.53 119.82 21.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.269 -0.423 . . . . 74.5 110.24 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 15.0 t -71.64 144.51 49.39 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.184 0.516 . . . . 71.33 110.234 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . 0.496 ' N ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -113.98 10.3 17.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.052 -0.522 . . . . 73.23 109.983 -179.387 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -79.4 -36.2 39.49 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.112 -0.699 . . . . 54.42 109.112 175.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.77 133.79 47.2 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.809 -0.812 . . . . 74.33 108.809 172.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.519 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.3 OUTLIER -151.17 88.72 1.47 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.348 0.594 . . . . 62.25 111.164 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -101.92 -23.66 14.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.494 -0.775 . . . . 72.53 109.289 176.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -92.61 -22.63 19.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.505 -0.77 . . . . 55.33 110.406 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.519 ' O ' ' HB ' ' A' ' 498' ' ' THR . 27.7 m-85 -128.97 161.05 30.81 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.402 -0.363 . . . . 74.03 110.355 -176.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 502' ' ' ARG . . . . . 0.429 ' HD2' ' HA ' ' A' ' 502' ' ' ARG . 2.1 tpt180 -152.94 123.84 7.41 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.171 -0.678 . . . . 72.42 109.171 173.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -95.03 112.84 24.5 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.191 -0.459 . . . . 64.2 110.39 -176.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.93 124.48 48.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.973 0.416 . . . . 75.3 110.635 178.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.556 ' HD2' ' HA2' ' A' ' 481' ' ' GLY . 1.6 tppp? -91.5 126.38 36.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.706 -0.679 . . . . 75.23 109.577 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -148.12 84.3 1.51 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.327 0.584 . . . . 74.44 110.573 -176.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.4 -127.22 29.01 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.669 -0.696 . . . . 53.44 112.699 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 26.0 mt-30 -84.66 -3.65 58.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.562 0.22 . . . . 74.42 111.46 -178.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -118.09 153.88 33.02 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.493 0.663 . . . . 71.41 111.176 -177.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . 0.639 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 36.3 m-70 -124.88 126.21 45.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.416 -0.811 . . . . 74.02 109.17 -179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 64.8 m-70 -101.54 117.33 34.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.518 -0.549 . . . . 74.13 109.518 -177.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 55.4 tp -101.32 121.68 42.32 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.293 -0.412 . . . . 70.03 110.059 178.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 10.8 tp -106.39 130.3 58.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.729 -0.471 . . . . 73.33 109.729 176.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.6 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 54.6 mt -105.47 112.59 39.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.781 -0.822 . . . . 73.02 108.781 171.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -75.34 -48.49 22.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.956 -0.566 . . . . 64.42 110.646 -176.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -122.18 108.41 13.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.87 -0.605 . . . . 71.2 110.125 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -101.82 136.45 41.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.1 -0.5 . . . . 51.43 111.288 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . 0.435 ' HA ' HG12 ' A' ' 467' ' ' VAL . 9.3 mmt -126.47 175.97 7.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.951 -0.568 . . . . 75.44 110.711 175.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.501 ' H ' HD22 ' A' ' 519' ' ' LEU . 2.9 mm? -61.49 -55.66 28.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.38 -0.373 . . . . 75.32 111.586 -171.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -84.14 -10.15 58.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.821 0.343 . . . . 75.42 111.376 -177.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -80.15 -13.0 59.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.128 -0.487 . . . . 44.32 109.876 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.601 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -70.73 -41.64 71.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.195 -0.457 . . . . 63.31 111.021 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.54 -158.25 0.07 OUTLIER Glycine 0 CA--C 1.523 0.583 0 N-CA-C 114.975 0.75 . . . . 63.04 114.975 176.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -117.22 110.9 18.71 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.271 -0.64 . . . . 72.45 109.271 174.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . 0.665 ' HE1' HD11 ' A' ' 493' ' ' LEU . 30.1 m-85 -85.03 131.72 34.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.489 0.662 . . . . 54.42 111.756 -174.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.78 126.74 25.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.958 -1.019 . . . . 63.54 109.699 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 47.4 tp -87.99 115.29 25.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.135 -0.484 . . . . 75.13 109.971 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . 0.557 ' SG ' HD13 ' A' ' 487' ' ' LEU . 76.3 m -94.61 113.08 24.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.133 0.492 . . . . 72.54 109.864 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.441 ' C ' ' H ' ' A' ' 531' ' ' GLY . 54.6 p -116.85 -166.78 1.2 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.573 -0.74 . . . . 61.53 111.401 -174.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . 0.455 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 19.2 m -59.88 6.56 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.792 1.237 . . . . 71.45 113.234 174.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . 0.441 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.47 28.22 1.65 Allowed Glycine 0 C--O 1.228 -0.251 0 C-N-CA 120.992 -0.623 . . . . 74.14 113.677 -176.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -116.55 138.14 14.16 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 109.607 -1.397 . . . . 73.21 109.607 163.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.67 143.31 51.09 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 117.8 0.8 . . . . 73.53 112.302 -172.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -154.59 143.78 21.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.103 -0.953 . . . . 64.52 109.097 175.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.448 HD13 ' N ' ' A' ' 536' ' ' ALA . 3.2 tm? -127.02 135.73 51.24 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.852 -0.425 . . . . 53.03 109.852 -176.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.691 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -135.43 159.99 39.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.267 -0.424 . . . . 74.34 110.561 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -125.56 120.42 30.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.044 -0.526 . . . . 75.41 110.218 -178.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' A' ' 522' ' ' ALA . 50.3 tp -99.67 126.99 45.78 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.264 -0.643 . . . . 71.41 109.264 178.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.423 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 66.4 mt -113.79 116.75 53.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 116.372 -0.376 . . . . 71.33 110.323 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.617 HG22 HG23 ' A' ' 465' ' ' VAL . 95.4 t -109.66 134.34 52.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.496 -0.557 . . . . 74.41 109.496 175.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.05 164.37 18.71 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.022 -0.733 . . . . 62.11 109.022 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -86.9 105.23 16.93 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.571 -0.529 . . . . 64.4 109.571 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 53.6 pttt . . . . . 0 C--O 1.247 0.929 0 CA-C-N 115.679 -0.691 . . . . 74.25 109.471 178.241 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo . . . . . 0 N--CA 1.458 -0.598 0 N-CA-C 110.644 -0.56 . . . . 62.44 110.644 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.575 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 58.8 t -65.95 114.24 3.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.918 0.389 . . . . 73.33 110.883 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 44.5 tp -89.2 157.77 18.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.686 -0.688 . . . . 50.01 110.545 -177.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.579 HD13 HD23 ' A' ' 527' ' ' LEU . 37.5 mt -101.96 112.61 35.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.052 -0.522 . . . . 75.13 110.087 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 20.9 p -86.49 -26.91 24.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.29 -0.414 . . . . 63.54 111.556 -176.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.503 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 7.1 tpt180 -107.1 114.35 61.42 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.277 -0.42 . . . . 74.42 110.091 177.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 458' ' ' ARG . 37.4 Cg_endo -65.95 158.12 55.78 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 122.589 2.193 . . . . 62.11 111.446 176.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.625 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 8.8 mp -73.61 160.45 31.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.115 -0.493 . . . . 43.54 110.574 -178.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . 0.479 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 0.2 OUTLIER -65.0 146.99 54.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.512 0.673 . . . . 72.44 112.216 -173.599 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -104.35 7.36 35.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.933 -1.031 . . . . 71.54 112.515 -171.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . 0.478 HE22 ' HB3' ' A' ' 461' ' ' GLU . 0.2 OUTLIER -124.49 154.13 40.99 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.872 -0.731 . . . . 72.24 111.805 -167.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.695 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.3 pt? -118.44 145.46 45.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.825 -1.079 . . . . 70.01 111.414 -168.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.443 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 29.3 m -119.77 177.15 3.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 53.13 111.485 -176.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -107.83 172.03 7.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.919 -0.582 . . . . 74.22 110.383 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 40.3 t -62.45 130.31 26.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.455 -0.339 . . . . 72.43 110.995 -178.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 90.54 7.37 67.02 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.776 -0.726 . . . . 62.24 112.626 178.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -117.85 138.73 51.91 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.884 0.373 . . . . 72.24 110.525 178.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . 0.554 ' O ' ' HD3' ' A' ' 470' ' ' ARG . 0.0 OUTLIER -82.02 153.6 26.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.697 -0.683 . . . . 65.21 111.451 -179.124 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.433 HG12 ' HB ' ' A' ' 514' ' ' ILE . 7.4 p -145.42 131.08 13.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.991 -0.549 . . . . 73.02 110.58 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.437 ' CG ' HD13 ' A' ' 513' ' ' ILE . 41.0 mt-10 -99.37 128.21 45.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.433 -0.349 . . . . 74.3 110.964 177.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.479 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 92.9 m-85 -107.6 112.16 24.75 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.625 -0.88 . . . . 74.04 108.625 167.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -96.45 140.24 31.38 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.232 0.539 . . . . 75.1 110.623 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.591 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 8.7 p -139.25 137.81 36.24 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.451 -0.795 . . . . 75.31 109.779 176.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.503 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 45.3 mt-10 -119.46 138.98 52.78 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.529 -0.545 . . . . 70.5 109.529 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.575 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 9.6 m -122.58 152.14 26.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 116.106 -0.497 . . . . 74.41 110.917 -177.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 6.5 m -63.19 -19.63 64.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.818 -0.628 . . . . 61.13 112.094 -178.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . 0.499 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 35.8 tt0 -108.75 135.25 50.28 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.819 0.342 . . . . 75.32 110.437 -176.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . 0.667 ' HA ' ' HG2' ' A' ' 508' ' ' GLN . 13.7 pt-20 -75.49 135.96 40.64 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.177 -0.465 . . . . 71.34 110.577 -178.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . 0.445 ' HA2' ' HD3' ' A' ' 505' ' ' LYS . . . 67.05 8.74 51.26 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.145 -0.55 . . . . 41.11 113.075 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.527 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -57.67 139.59 53.36 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 120.849 0.356 . . . . 74.23 111.221 -177.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -79.43 128.29 33.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.648 -0.705 . . . . 65.13 110.143 -177.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.619 ' HB ' HD11 ' A' ' 527' ' ' LEU . 32.7 m -121.88 150.85 25.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.253 -0.431 . . . . 73.15 110.258 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -134.83 134.98 41.39 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.766 -0.457 . . . . 63.23 109.766 179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . 0.431 ' CD2' HD22 ' A' ' 512' ' ' LEU . 72.0 m95 -103.34 131.46 50.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.919 0.39 . . . . 75.52 111.165 -175.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . 0.567 ' HG ' ' HA ' ' A' ' 492' ' ' GLU . 10.7 mp -120.02 158.02 27.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.903 -0.589 . . . . 72.14 109.47 174.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.468 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 1.7 tmmm? -140.81 109.27 5.88 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.116 -0.327 . . . . 75.45 110.116 -178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 57.63 35.4 25.64 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.898 -0.592 . . . . 74.42 111.061 -177.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 86.94 -11.78 63.76 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.778 -0.646 . . . . 72.24 112.741 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 60.7 t -79.03 122.95 35.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.805 -0.443 . . . . 44.32 109.805 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . 0.567 ' HA ' ' HG ' ' A' ' 487' ' ' LEU . 33.4 tt0 -78.71 111.31 14.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.902 -0.59 . . . . 72.25 110.2 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 86.9 mt -68.37 134.94 51.03 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.016 0.436 . . . . 61.03 110.177 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 14.3 t -91.58 160.16 15.54 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.978 -0.555 . . . . 71.22 110.024 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 -125.82 11.94 7.84 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.813 -0.63 . . . . 74.31 110.559 -177.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -75.55 -35.06 60.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.613 -0.721 . . . . 53.54 109.801 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -136.23 139.6 42.86 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.621 -0.881 . . . . 73.31 108.621 170.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.562 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.6 OUTLIER -150.37 88.01 1.48 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.434 0.635 . . . . 63.51 111.166 179.094 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -104.94 -17.97 14.35 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.591 -0.732 . . . . 52.24 109.912 174.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -92.72 -47.05 7.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.733 -0.667 . . . . 65.41 109.841 174.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.562 ' O ' ' HB ' ' A' ' 498' ' ' THR . 45.6 m-85 -103.17 161.21 13.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.928 -0.578 . . . . 70.13 109.926 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 502' ' ' ARG . . . . . 0.472 ' HB2' HG23 ' A' ' 513' ' ' ILE . 49.1 mtp180 -144.34 135.49 25.35 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.175 -0.676 . . . . 61.4 109.175 174.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -107.4 113.14 26.31 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.475 -0.565 . . . . 73.23 109.475 -175.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -120.4 145.83 46.8 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.858 -0.61 . . . . 62.21 110.968 -172.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.445 ' HD3' ' HA2' ' A' ' 481' ' ' GLY . 3.7 ttmp? -128.82 118.42 22.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.847 -0.615 . . . . 73.14 109.846 -178.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . 0.54 ' HB3' ' HG3' ' A' ' 509' ' ' ARG . 15.3 t70 -127.62 82.73 2.1 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.421 -0.585 . . . . 73.31 109.421 177.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.37 -101.18 0.59 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.059 -0.591 . . . . 75.42 112.041 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.667 ' HG2' ' HA ' ' A' ' 480' ' ' GLU . 20.9 mt-30 -109.19 -8.63 15.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.824 0.345 . . . . 73.42 110.822 -179.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.54 ' HG3' ' HB3' ' A' ' 506' ' ' ASP . 36.7 ptt180 -104.94 133.25 50.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.363 0.601 . . . . 60.1 110.761 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . 0.591 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 83.2 m-70 -113.65 144.62 42.61 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.818 -0.628 . . . . 73.42 109.792 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -119.8 118.32 30.51 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 110.134 -0.321 . . . . 71.01 110.134 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.431 HD22 ' CD2' ' A' ' 486' ' ' TRP . 53.2 tp -96.55 103.5 15.42 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.597 -0.89 . . . . 64.2 108.597 170.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.554 HD11 ' HB2' ' A' ' 470' ' ' ARG . 5.4 tp -101.34 112.63 34.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 121.482 0.658 . . . . 61.52 110.505 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.519 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 60.9 mt -86.46 115.53 27.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 108.482 -0.933 . . . . 64.2 108.482 174.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -68.82 -51.52 39.84 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.961 0.41 . . . . 72.34 110.537 -177.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -133.76 109.41 9.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.802 -0.636 . . . . 74.53 109.841 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -88.0 138.43 31.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.974 0.416 . . . . 71.41 111.017 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . 0.648 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 25.4 mmt -109.34 170.12 8.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.923 -0.58 . . . . 62.12 110.371 179.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.556 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.0 mm? -64.24 -53.52 47.78 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.241 -0.436 . . . . 72.13 111.229 -173.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -81.38 -5.06 57.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.262 -0.426 . . . . 75.43 110.907 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . 0.648 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 7.9 t70 -86.8 -14.56 41.87 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.088 -0.505 . . . . 74.02 110.57 -176.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.673 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -69.16 -43.67 73.81 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.817 -0.353 . . . . 75.51 111.344 -175.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . 0.468 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 40.27 -158.53 0.02 OUTLIER Glycine 0 CA--C 1.524 0.655 0 N-CA-C 115.9 1.12 . . . . 74.41 115.9 172.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -111.14 111.55 22.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.78 -0.71 . . . . 73.13 109.086 170.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . 0.454 ' HH ' ' HE1' ' A' ' 501' ' ' TYR . 40.4 m-85 -86.19 131.53 34.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.028 0.442 . . . . 71.24 111.103 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -132.27 126.09 32.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.589 -0.732 . . . . 72.21 110.073 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.619 HD11 ' HB ' ' A' ' 484' ' ' VAL . 45.5 tp -86.9 119.92 27.63 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.196 -0.456 . . . . 73.23 110.12 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . 0.504 ' SG ' HD13 ' A' ' 487' ' ' LEU . 86.4 m -100.88 112.97 25.51 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.457 -0.571 . . . . 61.32 109.457 177.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.533 HG23 HG12 ' A' ' 484' ' ' VAL . 0.2 OUTLIER -115.89 -168.39 1.41 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.642 -0.708 . . . . 40.0 110.389 -175.946 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . 0.447 ' H ' HG22 ' A' ' 529' ' ' THR . 7.5 m -55.21 7.25 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.935 1.294 . . . . 22.42 113.694 173.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . 0.524 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.9 26.83 2.01 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-O 121.638 0.577 . . . . 72.43 111.831 -168.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -114.91 150.23 18.74 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 109.684 -1.366 . . . . 52.41 109.684 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . 0.415 ' NE2' ' H ' ' A' ' 534' ' ' ALA . 0.0 OUTLIER -134.77 142.75 46.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 117.55 0.675 . . . . 72.03 110.762 -176.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . 0.415 ' H ' ' NE2' ' A' ' 533' ' ' GLN . . . -153.06 123.48 7.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.656 -0.702 . . . . 72.44 109.778 177.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.438 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.7 tm? -103.99 132.82 49.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.173 -0.467 . . . . 74.51 110.114 -177.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.625 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -121.02 149.25 42.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.37 -0.377 . . . . 53.11 110.42 177.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -116.31 120.58 39.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.173 -0.467 . . . . 62.12 110.084 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 522' ' ' ALA . 48.3 tp -127.51 134.73 49.78 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.284 -0.416 . . . . 71.42 110.462 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.579 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.8 mp -130.8 125.23 58.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.128 -0.693 . . . . 64.13 109.128 174.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.673 HG23 ' HB2' ' A' ' 522' ' ' ALA . 70.1 t -104.41 143.71 15.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 110.02 -0.363 . . . . 63.32 110.02 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . 0.408 ' N ' HE21 ' A' ' 541' ' ' GLN . 0.0 OUTLIER -126.29 150.26 48.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.756 0.312 . . . . 63.3 110.628 -176.642 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . 0.556 ' HG3' HD11 ' A' ' 519' ' ' LEU . 45.2 mt-10 -89.5 123.33 33.51 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.698 -0.683 . . . . 55.25 110.185 175.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . 0.509 ' HD2' ' C ' ' A' ' 543' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.89 0 CA-C-N 115.6 -0.727 . . . . 72.44 109.809 177.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo . . . . . 0 N--CA 1.462 -0.367 0 CA-C-O 120.723 0.218 . . . . 42.22 111.662 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.495 ' H ' ' HB2' ' A' ' 530' ' ' SER . 87.2 t -64.51 108.79 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.215 0.531 . . . . 64.42 110.408 178.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 50.1 tp -80.63 139.29 36.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.595 -0.73 . . . . 73.54 110.17 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 55.1 mt -91.14 114.93 29.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.867 -0.606 . . . . 72.32 109.789 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 24.7 p -86.2 -17.96 33.44 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.264 0.554 . . . . 75.33 111.498 -175.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.42 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 10.9 tpt85 -136.95 104.64 8.87 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.955 -0.566 . . . . 73.45 110.359 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . 0.41 ' HA ' ' HB1' ' A' ' 534' ' ' ALA . 26.2 Cg_exo -62.71 167.38 11.87 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.891 2.394 . . . . 54.32 111.285 174.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.689 ' HB2' ' CB ' ' A' ' 536' ' ' ALA . 0.8 OUTLIER -69.81 167.84 16.37 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.606 -0.516 . . . . 63.53 109.606 -177.79 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . 0.531 ' HA ' ' OE1' ' A' ' 461' ' ' GLU . 2.4 tp10 -73.15 161.59 30.42 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.264 0.554 . . . . 74.34 111.64 -172.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -104.25 8.76 36.16 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.989 1.107 . . . . 74.52 113.989 -166.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.11 154.23 37.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.381 0.991 . . . . 54.23 112.471 -165.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.686 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.5 pt? -106.56 146.83 30.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.051 -1.431 . . . . 74.3 111.576 -170.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.466 HG22 HD11 ' A' ' 538' ' ' LEU . 30.1 m -123.36 177.41 4.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.006 0.431 . . . . 65.32 111.457 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -97.5 166.75 11.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.008 -0.542 . . . . 74.23 110.986 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . 0.409 HG22 HG12 ' A' ' 540' ' ' VAL . 38.3 t -62.08 127.35 21.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.716 -0.675 . . . . 33.25 111.604 -176.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 88.16 -13.35 61.82 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.003 -0.617 . . . . 72.04 113.144 174.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -87.58 144.58 26.62 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.95 -0.389 . . . . 61.01 109.95 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . 0.627 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 2.3 ppt_? -76.65 145.56 38.74 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.276 0.56 . . . . 65.22 111.234 -177.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.445 HG12 ' HB ' ' A' ' 514' ' ' ILE . 7.2 p -131.9 142.26 43.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.674 -0.694 . . . . 72.43 109.978 178.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.562 ' HG2' HD13 ' A' ' 513' ' ' ILE . 34.1 mt-10 -112.19 125.3 53.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 75.54 110.546 -176.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.525 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 59.6 m-85 -112.88 123.2 49.77 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.287 -0.415 . . . . 65.11 111.34 178.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -95.02 138.33 32.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.736 -0.666 . . . . 63.42 110.543 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.644 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 6.0 p -148.81 133.3 17.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.25 -0.432 . . . . 53.4 110.387 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.48 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 43.9 mt-10 -131.78 139.81 49.02 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.36 -0.237 . . . . 64.41 110.36 -178.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 30.1 m -123.41 161.15 25.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.343 -0.39 . . . . 72.12 110.488 177.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 34.3 t -80.9 8.47 8.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.271 -0.422 . . . . 53.52 112.114 -175.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . 0.546 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 4.5 tp10 -128.85 141.27 51.35 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.029 -0.359 . . . . 70.4 110.029 -179.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . 0.51 ' HA ' ' HG2' ' A' ' 508' ' ' GLN . 1.0 OUTLIER -88.84 136.92 32.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.746 0.308 . . . . 74.41 110.426 -178.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 60.55 31.75 75.79 Favored Glycine 0 C--N 1.33 0.217 0 C-N-CA 120.706 -0.759 . . . . 71.13 111.783 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.546 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -74.46 146.27 42.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.951 0.405 . . . . 63.25 111.303 -175.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . 0.527 ' CD ' ' H ' ' A' ' 483' ' ' GLN . 0.0 OUTLIER -78.2 111.33 14.02 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.764 -0.653 . . . . 63.14 110.326 179.318 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.68 HG12 HG22 ' A' ' 529' ' ' THR . 17.3 m -131.86 151.21 34.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.666 -0.697 . . . . 71.4 110.245 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -135.06 155.13 51.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.902 0.382 . . . . 75.04 110.196 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . 0.584 ' HB3' HD12 ' A' ' 493' ' ' LEU . 52.2 m95 -105.57 127.24 52.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.132 -0.486 . . . . 63.54 110.908 -179.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . 0.554 HD12 ' SG ' ' A' ' 528' ' ' CYS . 65.1 mt -123.96 136.59 54.41 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.847 -0.615 . . . . 73.01 109.415 175.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.501 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 3.3 tmmm? -120.65 106.47 11.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.303 -0.408 . . . . 71.23 110.215 -177.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . 0.54 ' HB2' ' H ' ' A' ' 524' ' ' HIS . 13.7 t70 57.14 35.55 26.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.541 -0.754 . . . . 72.05 110.86 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 88.43 -3.72 85.28 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.794 -0.639 . . . . 62.24 112.513 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 89.5 t -94.69 128.2 46.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.722 0.296 . . . . 71.11 110.818 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . 0.524 ' HA ' ' CD2' ' A' ' 487' ' ' LEU . 4.7 tp10 -70.01 126.96 31.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.847 -0.615 . . . . 73.51 110.432 178.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.584 HD12 ' HB3' ' A' ' 486' ' ' TRP . 75.8 mt -87.55 98.01 11.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.119 0.485 . . . . 60.34 109.753 175.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . 0.504 ' OG1' ' HG2' ' A' ' 496' ' ' GLU . 6.2 t -64.27 123.33 18.84 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.599 -0.728 . . . . 72.04 111.223 -176.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . 0.636 ' H ' ' NE ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -100.61 13.07 35.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.042 -0.526 . . . . 62.34 110.768 -179.264 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . 0.504 ' HG2' ' OG1' ' A' ' 494' ' ' THR . 10.1 mm-40 -69.22 -36.66 77.48 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.325 -0.62 . . . . 74.32 109.325 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -151.53 108.22 3.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.143 -0.935 . . . . 71.51 109.364 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.6 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 21.3 p -114.42 97.8 6.53 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.154 -0.475 . . . . 73.45 111.547 -176.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -91.03 -28.95 17.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.9 -0.591 . . . . 74.12 110.192 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -88.76 -46.97 8.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.941 -0.572 . . . . 75.45 110.312 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.6 ' O ' ' HB ' ' A' ' 498' ' ' THR . 26.2 m-85 -99.32 154.96 17.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.624 -0.716 . . . . 65.04 110.093 -176.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 502' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 501' ' ' TYR . 21.5 mtp85 -148.09 123.17 10.12 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.549 -0.537 . . . . 75.53 109.549 171.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . 0.464 ' HE2' HG21 ' A' ' 498' ' ' THR . 72.6 m-85 -96.06 118.37 32.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.02 -0.537 . . . . 72.32 111.465 -172.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 4.6 mptp? -105.85 146.0 30.49 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.239 -0.437 . . . . 62.21 110.054 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.433 ' HD3' ' CE1' ' A' ' 510' ' ' HIS . 26.5 ttpt -129.37 128.06 42.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.85 0.357 . . . . 71.55 111.149 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -119.05 79.03 1.34 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.657 -0.701 . . . . 75.13 109.512 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.49 -90.78 0.24 Allowed Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.838 -0.619 . . . . 53.13 112.807 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.51 ' HG2' ' HA ' ' A' ' 480' ' ' GLU . 22.7 mt-30 -99.14 -26.06 14.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.804 0.335 . . . . 61.1 111.019 -177.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.48 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 17.1 ptt180 -103.55 153.74 20.24 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.21 0.529 . . . . 72.03 111.485 -173.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . 0.644 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 64.3 m-70 -124.64 156.54 37.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.045 -0.525 . . . . 74.11 110.76 -179.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 42.0 m-70 -125.99 119.3 27.34 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.08 -0.711 . . . . 75.14 109.08 176.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.525 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 64.4 tp -98.3 105.68 17.86 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.447 -0.575 . . . . 75.24 109.447 174.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.562 HD13 ' HG2' ' A' ' 472' ' ' GLU . 8.5 tp -97.54 112.81 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 CA-C-O 121.502 0.668 . . . . 44.42 109.571 176.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.627 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 45.1 mt -96.66 112.08 28.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.611 -0.885 . . . . 61.03 108.611 175.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . 0.442 HD21 ' HD3' ' A' ' 502' ' ' ARG . 41.0 m-80 -68.81 -45.01 72.32 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.445 0.466 . . . . 74.03 111.353 -173.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -134.32 109.59 8.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.198 -0.456 . . . . 42.43 110.185 178.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.542 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -88.27 123.07 32.51 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.097 -0.501 . . . . 52.45 110.344 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . 0.724 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 30.2 mmt -90.05 173.36 8.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.256 -0.429 . . . . 75.12 110.103 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.32 -54.03 50.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.949 0.404 . . . . 75.1 110.853 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -82.89 -4.48 58.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.752 -0.658 . . . . 53.25 111.103 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . 0.724 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 6.8 t70 -80.41 -19.78 45.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.305 -176.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.527 ' HA ' HD23 ' A' ' 538' ' ' LEU . . . -62.66 -41.93 99.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.147 -0.479 . . . . 64.2 111.268 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.19 -157.32 0.07 OUTLIER Glycine 0 C--N 1.335 0.513 0 O-C-N 123.924 0.765 . . . . 65.2 114.811 173.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . 0.54 ' H ' ' HB2' ' A' ' 489' ' ' ASP . 60.5 m80 -120.66 108.65 14.27 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.734 -0.839 . . . . 74.25 108.734 171.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . 0.501 ' CZ ' ' HG3' ' A' ' 488' ' ' LYS . 26.3 m-85 -85.46 132.04 34.28 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.472 0.654 . . . . 74.2 111.857 -173.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -141.29 131.86 25.46 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.113 -0.949 . . . . 44.02 109.818 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.49 HD22 ' HB2' ' A' ' 475' ' ' CYS . 61.2 tp -86.67 116.3 24.69 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.245 -0.65 . . . . 71.44 109.245 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . 0.554 ' SG ' HD12 ' A' ' 487' ' ' LEU . 64.6 m -99.73 116.31 31.52 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.424 0.63 . . . . 63.22 110.597 -176.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.68 HG22 HG12 ' A' ' 484' ' ' VAL . 68.0 p -115.64 -165.67 1.06 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.95 -1.023 . . . . 71.43 110.229 -177.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . 0.495 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 2.7 m -52.68 4.25 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.645 1.178 . . . . 70.04 113.274 172.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . 0.522 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.85 27.59 1.87 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.392 -0.432 . . . . 72.11 113.233 -175.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -107.95 136.22 13.32 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 109.797 -1.321 . . . . 54.22 109.797 164.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -113.03 121.06 43.48 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 117.201 0.5 . . . . 72.43 112.224 -171.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . 0.41 ' HB1' ' HA ' ' A' ' 459' ' ' PRO . . . -121.26 140.21 52.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.933 -0.576 . . . . 74.01 109.474 171.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.492 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.8 tm? -128.36 138.94 52.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.767 0.318 . . . . 72.44 110.48 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.689 ' CB ' ' HB2' ' A' ' 460' ' ' LEU . . . -146.94 159.92 42.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 74.53 110.112 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -127.04 116.75 21.21 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.057 0.456 . . . . 73.12 111.057 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.527 HD23 ' HA ' ' A' ' 522' ' ' ALA . 52.6 tp -101.22 133.08 46.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.038 -0.727 . . . . 74.42 109.038 175.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.68 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 35.5 mt -125.49 116.7 47.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 109.762 -0.459 . . . . 74.22 109.762 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.542 HG21 ' HB1' ' A' ' 517' ' ' ALA . 97.8 t -112.81 120.16 62.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 120.771 0.319 . . . . 54.54 110.513 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.58 162.21 30.86 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.943 -0.571 . . . . 55.52 109.798 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -85.33 109.12 18.16 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.44 -0.578 . . . . 61.31 109.44 173.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . 0.838 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 10.7 mmpt? . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.426 -0.797 . . . . 71.31 109.701 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo . . . . . 0 N--CA 1.459 -0.501 0 N-CA-C 111.287 -0.313 . . . . 74.12 111.287 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.435 ' H ' ' HB2' ' A' ' 530' ' ' SER . 99.2 t -64.93 107.67 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-O 121.199 0.523 . . . . 54.33 110.063 176.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 47.3 tp -93.63 152.54 18.93 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.512 -0.767 . . . . 72.41 109.562 -177.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 56.6 mt -105.71 112.9 41.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.205 -0.452 . . . . 74.42 110.234 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 43.8 p -86.43 -33.91 20.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.181 0.515 . . . . 70.23 110.416 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.485 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 14.3 tpt180 -114.77 103.91 54.54 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.541 -0.754 . . . . 75.54 109.26 174.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.2 167.57 19.86 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.968 2.445 . . . . 65.44 112.272 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.878 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 79.6 mt -66.11 155.24 37.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.032 -0.531 . . . . 74.1 110.078 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -88.35 162.68 16.42 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.302 0.853 . . . . 73.31 113.302 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -104.53 6.33 34.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.245 -1.343 . . . . 72.54 113.93 -161.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -123.86 149.31 45.94 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 118.923 -1.111 . . . . 62.42 112.753 -162.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.612 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 0.6 OUTLIER -114.48 144.9 42.6 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.97 -1.468 . . . . 71.4 111.391 -170.523 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 28.2 m -117.92 177.93 2.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.115 -0.493 . . . . 63.22 111.303 -177.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -103.14 168.07 9.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.012 -0.54 . . . . 71.33 110.382 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 45.0 t -62.21 130.33 26.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.472 -0.331 . . . . 72.24 110.829 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 92.46 -11.22 72.61 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.877 -0.678 . . . . 45.21 112.616 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -101.09 144.17 30.32 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.431 -0.581 . . . . 73.42 109.431 178.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . 0.494 ' HD2' ' C ' ' A' ' 470' ' ' ARG . 0.0 OUTLIER -86.01 150.61 24.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.965 0.412 . . . . 64.13 110.72 -176.13 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.413 HG12 ' HB ' ' A' ' 514' ' ' ILE . 8.0 p -128.94 137.59 56.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.445 -0.576 . . . . 55.33 109.445 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.852 ' HG2' HG13 ' A' ' 513' ' ' ILE . 42.6 mt-10 -116.61 124.28 49.41 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.489 -0.323 . . . . 73.25 110.159 -176.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.456 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 76.9 m-85 -107.97 113.27 26.33 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.116 -0.493 . . . . 65.21 110.286 176.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -95.61 132.36 40.84 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.657 -0.701 . . . . 74.35 110.295 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.4 t -148.26 121.02 8.66 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.095 0.474 . . . . 53.43 110.507 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.902 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 46.5 mt-10 -112.63 138.72 49.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.799 -0.637 . . . . 73.32 110.058 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.508 HG21 ' HB3' ' A' ' 482' ' ' ALA . 21.6 m -121.93 178.44 2.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.383 -0.371 . . . . 65.41 110.781 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 25.0 p -78.22 -21.61 49.73 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.598 0.592 . . . . 50.1 112.598 -174.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . 0.674 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 35.9 tt0 -119.02 138.91 52.5 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.997 0.427 . . . . 73.21 110.991 -175.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . 0.426 ' H ' ' CD ' ' A' ' 480' ' ' GLU . 1.4 pm0 -74.41 126.96 31.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.955 -0.566 . . . . 43.4 110.368 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 64.35 26.84 70.93 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.616 -0.802 . . . . 52.33 111.953 -174.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.674 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -57.94 156.76 8.65 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.012 0.745 . . . . 62.33 113.012 -176.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -71.86 105.48 3.82 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.886 -1.052 . . . . 64.24 109.553 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.54 ' HB ' HD11 ' A' ' 527' ' ' LEU . 29.3 m -128.06 150.7 34.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.908 0.385 . . . . 73.1 110.412 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 49.4 tttp -130.29 126.8 38.13 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.206 -0.664 . . . . 63.14 109.206 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . 0.412 ' HB3' HD12 ' A' ' 493' ' ' LEU . 86.1 m95 -100.92 116.81 33.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.739 0.304 . . . . 73.44 110.885 -175.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . 0.415 HD13 ' SG ' ' A' ' 528' ' ' CYS . 7.7 mp -118.23 140.8 49.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.035 -0.529 . . . . 61.23 110.393 177.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.537 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 4.2 tmmm? -127.22 107.45 10.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.142 -0.688 . . . . 50.25 109.142 176.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 4.7 t70 58.56 35.55 24.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.577 0.703 . . . . 73.12 110.353 -178.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 92.99 -15.58 62.5 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.824 -0.703 . . . . 70.54 113.281 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 55.9 t -97.85 123.99 50.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.81 0.305 . . . . 72.43 110.561 -178.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -70.44 142.6 51.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.932 0.396 . . . . 74.04 110.75 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.708 HD11 ' HE2' ' A' ' 525' ' ' TYR . 59.7 mt -84.71 118.39 24.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.901 -0.59 . . . . 75.41 110.197 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 10.6 t -70.46 143.14 51.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.06 0.457 . . . . 72.21 110.414 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.93 7.64 11.52 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.177 -0.465 . . . . 74.44 110.596 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -62.18 -50.38 72.06 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.517 0.675 . . . . 75.02 109.579 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -152.65 118.16 5.3 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.81 -1.086 . . . . 75.52 108.82 174.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.61 121.65 16.76 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.85 0.357 . . . . 73.44 110.597 -176.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -107.49 -22.9 12.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.272 -0.422 . . . . 64.34 111.51 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . 0.411 ' HE3' ' CE2' ' A' ' 501' ' ' TYR . 52.3 mtmt -73.97 -46.74 42.01 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.422 -0.585 . . . . 64.23 109.422 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.728 ' HB3' HG12 ' A' ' 514' ' ' ILE . 0.6 OUTLIER -136.09 144.98 45.45 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.282 -0.872 . . . . 73.51 110.298 179.032 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.88 140.32 51.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.068 0.461 . . . . 74.12 110.922 178.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -95.64 120.55 36.09 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.242 -0.89 . . . . 64.21 109.789 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 0.7 OUTLIER -113.54 121.31 43.83 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.072 0.463 . . . . 74.44 110.964 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -107.51 113.51 26.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.588 -0.733 . . . . 73.31 110.476 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.53 101.4 3.98 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.426 0.631 . . . . 74.0 110.581 174.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 80.06 -131.14 10.3 Favored Glycine 0 N--CA 1.444 -0.83 0 CA-C-N 115.456 -0.793 . . . . 52.24 111.895 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.451 ' HB3' ' O ' ' A' ' 477' ' ' VAL . 26.0 mt-30 -93.47 -10.63 34.34 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.817 0.341 . . . . 61.52 110.567 -178.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.902 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 25.5 ptt180 -93.52 143.83 25.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.546 0.688 . . . . 71.1 111.508 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 -124.5 117.71 24.98 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.441 -0.948 . . . . 73.33 108.441 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 13.3 m-70 -101.84 127.57 48.59 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.677 -0.238 . . . . 73.31 110.739 -172.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.456 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 63.0 tp -112.7 103.55 11.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.596 -0.52 . . . . 73.44 109.596 173.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.852 HG13 ' HG2' ' A' ' 472' ' ' GLU . 1.7 mp -105.08 116.28 48.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.1 -0.5 . . . . 60.43 110.329 179.248 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.728 HG12 ' HB3' ' A' ' 501' ' ' TYR . 53.7 mt -97.81 112.78 30.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.075 -0.713 . . . . 73.5 109.075 175.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -71.19 -44.25 65.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.091 -0.504 . . . . 72.32 110.542 -175.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -129.86 109.14 10.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.911 -0.586 . . . . 64.11 109.758 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -89.98 132.16 35.5 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.062 -0.517 . . . . 70.21 110.335 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 26.1 mmt -112.06 166.51 11.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.076 -0.511 . . . . 71.33 110.554 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.516 ' H ' HD22 ' A' ' 519' ' ' LEU . 2.9 mm? -58.18 -53.92 52.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 71.21 111.077 -174.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -82.6 -10.78 58.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.075 -0.511 . . . . 74.42 111.651 -176.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -85.9 -14.03 46.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.44 -0.346 . . . . 73.44 110.466 -177.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.644 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -62.72 -41.98 99.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.313 -0.403 . . . . 61.35 111.361 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.68 -158.13 0.08 OUTLIER Glycine 0 C--N 1.337 0.589 0 O-C-N 123.835 0.709 . . . . 60.51 114.472 176.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -126.97 112.38 15.2 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.605 -0.887 . . . . 74.02 108.605 172.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . 0.708 ' HE2' HD11 ' A' ' 493' ' ' LEU . 51.7 m-85 -85.74 131.97 34.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.238 0.542 . . . . 75.21 111.494 -172.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -137.55 120.07 16.02 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.553 -0.749 . . . . 64.4 110.035 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.54 HD11 ' HB ' ' A' ' 484' ' ' VAL . 45.2 tp -87.6 123.35 32.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.152 -0.476 . . . . 64.31 109.775 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . 0.415 ' SG ' HD13 ' A' ' 487' ' ' LEU . 64.6 m -108.68 112.73 25.19 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.054 0.454 . . . . 64.31 110.202 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.55 ' C ' ' H ' ' A' ' 531' ' ' GLY . 55.1 p -114.61 -165.2 0.99 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.085 -0.507 . . . . 72.53 109.716 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . 0.435 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 2.1 m -49.79 4.53 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.087 1.143 . . . . 71.24 114.087 173.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . 0.55 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.55 26.84 2.08 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 121.446 0.47 . . . . 74.12 112.789 -173.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -109.04 138.02 14.52 Favored Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 109.21 -1.556 . . . . 73.21 109.21 164.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.74 126.14 46.91 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 117.31 0.555 . . . . 64.3 111.201 -171.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . 0.413 ' HB1' ' H ' ' A' ' 460' ' ' LEU . . . -131.89 133.88 45.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.79 -0.641 . . . . 62.32 109.636 174.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.482 HD13 ' N ' ' A' ' 536' ' ' ALA . 1.4 tm? -116.81 133.69 55.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.933 -0.395 . . . . 72.13 109.933 -177.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.878 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -122.09 131.22 53.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.431 -0.35 . . . . 44.45 110.801 178.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -102.41 116.41 32.56 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.112 -0.494 . . . . 72.33 110.149 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.506 HD23 ' HA ' ' A' ' 522' ' ' ALA . 33.6 tp -124.11 118.75 27.63 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.266 -0.425 . . . . 72.1 110.088 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.612 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.2 mp -124.21 109.68 23.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 109.065 -0.717 . . . . 73.04 109.065 176.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.644 HG23 ' HB2' ' A' ' 522' ' ' ALA . 73.0 t -89.88 129.16 41.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.118 0.485 . . . . 75.51 110.249 -177.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -116.04 168.4 10.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.46 -0.791 . . . . 54.44 110.222 -174.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . 0.42 ' HG3' HD11 ' A' ' 519' ' ' LEU . 47.6 mt-10 -115.03 108.68 17.0 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.524 -0.307 . . . . 61.13 110.563 174.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 50.1 pttt . . . . . 0 C--O 1.247 0.93 0 CA-C-N 115.569 -0.742 . . . . 75.04 110.093 177.125 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.81 0 N-CA-C 111.639 -0.584 . . . . 71.4 111.639 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 10.7 m -84.2 96.72 9.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.959 0.409 . . . . 73.03 110.162 178.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 15.2 p80 -130.34 11.95 5.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.218 -0.446 . . . . 74.23 110.452 -179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 25.2 ptm -75.87 125.14 88.6 Favored Pre-proline 0 C--N 1.327 -0.406 0 N-CA-C 109.549 -0.537 . . . . 75.13 109.549 175.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -77.75 133.43 12.71 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.046 1.831 . . . . 73.44 112.267 -177.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.53 ' HB ' ' HB2' ' A' ' 530' ' ' SER . 65.6 t -65.94 108.78 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.295 -0.631 . . . . 73.43 109.295 172.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 54.7 tp -95.15 137.29 34.4 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.426 -0.807 . . . . 70.02 110.269 -175.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 58.1 mt -80.29 101.48 5.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.072 -0.714 . . . . 71.11 109.072 175.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 6.5 p -74.42 -18.97 60.57 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.909 -0.587 . . . . 62.42 111.964 -173.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.4 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 36.7 tpt85 -122.97 108.08 32.8 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.438 -0.346 . . . . 72.52 110.122 179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -59.92 158.95 27.1 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 123.146 2.564 . . . . 61.24 112.48 179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.61 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 94.9 mt -80.93 160.81 24.58 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.888 -0.596 . . . . 43.01 111.459 -174.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . 0.68 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 0.1 OUTLIER -65.91 139.59 58.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.652 -0.703 . . . . 71.43 112.069 -175.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -106.12 10.74 31.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.92 -1.037 . . . . 62.22 112.331 -173.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . 0.421 ' OE1' ' HG3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -120.63 153.03 37.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 119.685 -0.806 . . . . 51.23 112.362 -163.733 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.568 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.2 pt? -91.7 146.7 23.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 114.164 -1.38 . . . . 75.4 112.072 -169.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.499 HG21 HG22 ' A' ' 471' ' ' VAL . 28.2 m -125.32 178.43 3.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.822 -0.627 . . . . 64.13 111.121 -178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -118.36 161.65 19.6 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.095 -0.502 . . . . 73.32 110.775 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 52.7 t -66.17 126.59 25.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.173 -0.467 . . . . 74.03 110.738 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 95.13 -3.97 67.2 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.75 -0.738 . . . . 75.01 112.304 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -104.91 150.61 24.73 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.89 -0.411 . . . . 74.21 109.89 178.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . 0.463 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 17.3 ptp180 -81.58 153.19 26.85 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.984 0.421 . . . . 74.13 110.957 -177.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.499 HG22 HG21 ' A' ' 465' ' ' VAL . 2.3 t -120.57 119.33 59.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.044 -0.525 . . . . 72.52 109.93 177.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -106.02 119.18 38.54 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.064 -0.347 . . . . 62.03 110.064 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.68 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 98.3 m-85 -108.85 139.31 43.86 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.884 -0.598 . . . . 64.35 110.28 174.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.95 123.85 50.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.544 -0.298 . . . . 73.22 110.31 175.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 26.8 p -149.39 135.44 18.94 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.912 0.387 . . . . 64.32 110.479 177.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.442 ' HA ' ' HA ' ' A' ' 509' ' ' ARG . 43.8 mt-10 -128.18 155.52 44.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.895 -0.593 . . . . 73.31 109.437 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.5 HG21 ' HB3' ' A' ' 482' ' ' ALA . 14.2 m -125.3 166.68 20.66 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 116.424 -0.353 . . . . 72.52 110.461 177.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 25.8 p -78.93 8.4 5.64 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.438 0.533 . . . . 61.21 112.438 -174.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . 0.566 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 37.1 tt0 -144.54 133.93 23.19 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.048 -0.353 . . . . 75.32 110.048 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -79.0 134.11 36.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.317 0.579 . . . . 72.02 110.731 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . 0.516 ' HA2' ' HD3' ' A' ' 505' ' ' LYS . . . 71.4 16.28 75.48 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 115.47 -0.786 . . . . 72.24 112.118 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.566 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -61.56 156.54 19.41 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.146 0.498 . . . . 61.0 111.821 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -81.25 133.6 35.47 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.344 -0.844 . . . . 63.03 109.878 -178.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.565 ' HB ' HD11 ' A' ' 527' ' ' LEU . 26.8 m -137.36 175.53 9.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.892 0.377 . . . . 73.43 110.858 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . 0.569 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 55.9 tttp -151.31 122.63 7.8 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.306 -0.627 . . . . 71.55 109.306 -177.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -101.92 120.1 39.85 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.858 0.361 . . . . 72.2 111.143 -176.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . 0.524 HD21 ' HE3' ' A' ' 485' ' ' LYS . 98.0 mt -120.45 135.51 55.03 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.911 -0.586 . . . . 73.15 110.411 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.413 ' HE2' ' HB3' ' A' ' 488' ' ' LYS . 5.2 tmmm? -111.88 104.77 13.09 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.572 -0.899 . . . . 73.14 108.572 174.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.31 36.66 16.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.598 -0.728 . . . . 65.32 110.877 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.08 -14.11 61.53 Favored Glycine 0 CA--C 1.519 0.337 0 C-N-CA 120.833 -0.698 . . . . 32.04 113.266 177.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 39.9 t -100.76 123.2 53.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 122.47 -0.429 . . . . 54.23 110.43 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . 0.422 ' HA ' HD23 ' A' ' 487' ' ' LEU . 39.3 tt0 -71.77 135.69 46.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.98 0.419 . . . . 73.04 110.78 -179.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 91.1 mt -78.42 128.26 33.36 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.953 -0.567 . . . . 74.01 110.125 178.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 11.8 t -80.88 138.9 36.17 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.13 0.49 . . . . 75.02 110.036 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . 0.605 ' HA ' HG23 ' A' ' 498' ' ' THR . 0.0 OUTLIER -126.02 14.24 7.9 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.834 -0.621 . . . . 73.45 110.043 -178.01 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -70.49 -34.22 72.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.478 0.656 . . . . 60.35 109.304 179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -144.69 107.21 4.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.014 -0.994 . . . . 75.12 109.014 173.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.605 HG23 ' HA ' ' A' ' 495' ' ' ARG . 22.6 p -120.21 114.87 22.56 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.221 -0.445 . . . . 73.12 111.205 -176.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -111.82 -18.97 12.58 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.045 0.45 . . . . 71.05 111.039 170.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -99.38 -42.84 6.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.06 -0.518 . . . . 71.1 111.136 -176.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.49 ' HB3' HD11 ' A' ' 512' ' ' LEU . 46.4 m-85 -107.64 138.54 43.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.368 -0.378 . . . . 74.31 110.611 -176.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' ARG . . . . . 0.524 ' HB2' ' CG2' ' A' ' 513' ' ' ILE . 0.8 OUTLIER -118.34 123.95 46.58 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.704 0.288 . . . . 73.3 110.418 175.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . 0.438 ' CE2' HD13 ' A' ' 512' ' ' LEU . 89.5 m-85 -103.1 112.84 25.87 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.743 -0.662 . . . . 72.23 109.615 178.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.559 ' HE2' HG22 ' A' ' 513' ' ' ILE . 0.0 OUTLIER -113.79 135.82 53.54 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.978 0.418 . . . . 71.13 111.005 -179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.516 ' HD3' ' HA2' ' A' ' 481' ' ' GLY . 20.4 ttmt -115.15 111.89 21.71 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.537 -0.756 . . . . 64.53 109.699 177.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . 0.422 ' HB2' ' HG2' ' A' ' 509' ' ' ARG . 32.3 m-20 -119.58 88.17 2.88 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.542 -0.54 . . . . 73.12 109.542 177.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.65 -106.45 1.76 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.611 -0.805 . . . . 55.42 112.107 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -101.54 -15.9 16.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.582 0.229 . . . . 54.25 110.701 -177.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.442 ' HA ' ' HA ' ' A' ' 476' ' ' GLU . 26.6 ptt180 -89.76 151.54 21.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.196 0.522 . . . . 74.24 110.219 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 -132.06 136.35 47.14 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.012 -0.736 . . . . 61.44 109.012 175.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -123.9 124.09 41.86 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.008 0.432 . . . . 63.52 111.473 177.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.49 HD11 ' HB3' ' A' ' 501' ' ' TYR . 53.1 tp -105.46 102.72 12.17 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.19 -1.041 . . . . 74.34 108.19 169.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.559 HG22 ' HE2' ' A' ' 504' ' ' LYS . 8.0 tp -98.68 113.2 32.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-O 121.668 0.746 . . . . 73.5 109.8 -179.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.463 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 60.5 mt -88.6 115.96 29.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.309 -0.86 . . . . 73.45 109.365 178.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -63.81 -45.37 89.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.882 0.372 . . . . 73.21 111.056 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -141.83 110.91 6.29 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.95 -0.568 . . . . 63.24 110.074 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -83.29 137.14 34.11 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.09 -0.505 . . . . 73.33 110.953 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . 0.596 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 26.3 mmt -107.72 170.78 7.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.919 -0.582 . . . . 70.24 110.086 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.565 ' H ' HD22 ' A' ' 519' ' ' LEU . 2.4 mm? -64.07 -54.68 30.35 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.178 0.513 . . . . 73.1 110.808 -173.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -82.77 -4.84 58.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.645 -0.707 . . . . 74.34 111.089 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 1.0 OUTLIER -89.3 -7.49 55.28 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.081 -0.508 . . . . 74.44 111.509 -178.496 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.637 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -74.4 -43.72 55.16 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.76 -0.376 . . . . 53.25 111.371 -177.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 41.41 -158.11 0.04 OUTLIER Glycine 0 CA--C 1.526 0.767 0 CA-C-O 121.95 0.75 . . . . 72.12 114.845 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -111.51 113.79 26.45 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.07 -0.715 . . . . 73.24 109.07 169.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . 0.594 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 60.6 m-85 -84.35 130.95 34.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.083 0.468 . . . . 64.25 110.207 -178.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -137.87 119.65 15.21 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.657 -0.701 . . . . 71.3 110.276 179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.565 HD11 ' HB ' ' A' ' 484' ' ' VAL . 33.7 tp -89.78 109.59 20.57 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.255 -0.646 . . . . 73.21 109.255 178.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . 0.569 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 60.3 m -94.83 113.97 25.78 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.302 0.572 . . . . 75.13 110.24 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.511 HG22 HG12 ' A' ' 484' ' ' VAL . 55.8 p -116.13 -165.92 1.09 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.408 -0.815 . . . . 75.53 110.973 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . 0.53 ' HB2' ' HB ' ' A' ' 454' ' ' VAL . 33.1 m -52.87 5.05 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.451 1.1 . . . . 54.51 113.729 172.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . 0.511 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.79 27.44 1.91 Allowed Glycine 0 C--N 1.33 0.224 0 O-C-N 122.018 -0.426 . . . . 75.15 113.357 -177.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -111.75 134.58 12.18 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 109.658 -1.377 . . . . 72.43 109.658 164.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -119.09 120.54 37.45 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 117.193 0.496 . . . . 62.0 111.685 -172.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -121.3 143.3 49.25 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.799 -0.815 . . . . 43.12 108.799 171.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.437 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.4 tm? -128.54 133.56 48.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.001 0.429 . . . . 53.0 110.384 -174.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.61 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -127.65 131.11 49.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.915 -0.584 . . . . 54.21 110.272 176.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -113.49 115.7 28.43 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.19 -0.671 . . . . 44.32 109.19 176.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.475 HD11 HG22 ' A' ' 465' ' ' VAL . 37.6 tp -109.46 134.61 51.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.991 -0.55 . . . . 71.45 110.349 -173.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.512 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 43.1 mt -119.86 113.69 41.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 109.375 -0.602 . . . . 75.21 109.375 175.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.637 HG23 ' HB2' ' A' ' 522' ' ' ALA . 85.7 t -103.89 134.66 44.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.831 -0.433 . . . . 72.44 109.831 178.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.36 146.07 49.58 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.295 -0.411 . . . . 74.02 110.057 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -83.4 109.31 17.21 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.939 -0.763 . . . . 70.04 108.939 175.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . 0.785 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 10.9 mmpt? . . . . . 0 C--O 1.245 0.846 0 CA-C-O 118.306 -0.854 . . . . 72.33 109.753 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.764 0 N-CA-C 112.384 -0.286 . . . . 64.14 112.384 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 40.0 m -114.89 84.26 2.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.914 0.387 . . . . 51.4 110.409 176.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.85 41.41 0.29 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.201 0.524 . . . . 73.23 110.567 177.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 51.9 mtm -114.75 107.32 50.78 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-N 115.71 -0.677 . . . . 64.15 109.927 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -64.28 133.88 39.69 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 121.859 1.706 . . . . 72.42 110.04 172.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.418 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 92.2 t -64.36 107.6 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 121.37 0.605 . . . . 72.44 110.213 -176.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 44.1 tp -106.14 162.38 13.68 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.165 -0.925 . . . . 74.21 109.465 -177.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 34.1 mt -104.58 107.54 22.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 N-CA-C 110.041 -0.355 . . . . 72.43 110.041 -177.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . 0.5 ' O ' ' HD3' ' A' ' 459' ' ' PRO . 21.4 p -80.57 -44.01 19.7 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.316 0.579 . . . . 72.33 110.367 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.46 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 8.1 tpt85 -99.79 101.63 14.48 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 115.383 -0.826 . . . . 72.24 109.18 175.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . 0.5 ' HD3' ' O ' ' A' ' 457' ' ' THR . 17.0 Cg_exo -67.36 165.18 27.83 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 122.726 2.284 . . . . 65.43 111.493 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.694 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 3.2 mm? -65.86 166.45 11.18 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.357 -0.383 . . . . 75.44 110.395 -179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . 0.406 ' OE1' ' HA ' ' A' ' 461' ' ' GLU . 1.4 tp10 -69.87 157.17 37.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.481 0.657 . . . . 75.42 112.255 -172.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -105.49 7.67 33.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.883 -1.053 . . . . 63.15 113.649 -168.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -123.41 153.63 40.14 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.162 -1.015 . . . . 72.45 112.423 -167.678 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.658 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 1.8 pt? -108.75 145.47 35.09 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.177 -1.374 . . . . 72.33 110.89 -171.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.56 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 27.5 m -124.19 176.83 5.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.078 0.466 . . . . 73.44 111.21 -178.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -100.14 166.7 10.88 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.786 -0.643 . . . . 65.32 110.358 178.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . 0.419 HG21 ' HG2' ' A' ' 542' ' ' GLU . 24.5 t -60.03 138.25 21.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.329 -0.396 . . . . 73.43 111.254 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 82.18 -4.05 78.25 Favored Glycine 0 C--N 1.329 0.185 0 C-N-CA 121.192 -0.528 . . . . 55.25 112.809 176.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -102.46 143.32 32.34 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.181 -0.303 . . . . 75.44 110.181 -178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . 0.52 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 1.1 ptp180 -72.02 147.98 46.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.269 -0.423 . . . . 72.13 110.885 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.487 ' HB ' HG21 ' A' ' 465' ' ' VAL . 7.5 p -140.91 133.71 31.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.999 -0.546 . . . . 53.11 109.684 174.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.625 ' HG2' HD13 ' A' ' 513' ' ' ILE . 44.3 mt-10 -100.95 132.48 46.33 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.017 0.437 . . . . 71.55 110.968 -178.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.549 ' HB3' HD12 ' A' ' 460' ' ' LEU . 80.6 m-85 -124.09 112.28 16.94 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.042 -0.725 . . . . 74.01 109.042 169.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -118.52 138.65 52.38 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.102 0.477 . . . . 60.43 110.619 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.476 ' HB3' HD13 ' A' ' 460' ' ' LEU . 7.4 p -138.91 146.38 41.0 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.628 -0.714 . . . . 42.42 110.518 -178.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.608 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 44.3 mt-10 -116.38 138.08 51.64 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.213 -0.448 . . . . 73.14 109.821 176.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.473 HG21 ' HB3' ' A' ' 482' ' ' ALA . 14.2 m -119.27 164.83 15.19 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.86 -0.609 . . . . 74.13 110.874 -179.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 7.9 m -66.19 -12.87 58.75 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.723 0.638 . . . . 62.14 112.723 -174.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 40.8 tt0 -129.33 145.23 51.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.733 0.301 . . . . 75.13 110.847 -176.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . 0.525 ' CD ' ' H ' ' A' ' 480' ' ' GLU . 0.6 OUTLIER -79.69 126.95 31.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.188 -0.46 . . . . 72.12 110.541 -179.317 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 64.0 25.86 69.75 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.962 -0.637 . . . . 62.22 112.049 -176.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.602 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -58.44 152.9 16.92 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.148 0.499 . . . . 63.04 112.129 -177.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -76.32 111.95 12.31 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.26 -0.882 . . . . 65.31 109.875 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.6 ' HB ' HD11 ' A' ' 527' ' ' LEU . 35.2 m -124.98 150.72 30.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.172 -0.467 . . . . 64.15 111.077 -176.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 528' ' ' CYS . 45.4 tttp -121.86 129.72 52.81 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.177 -0.675 . . . . 62.12 109.177 179.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -101.17 126.84 47.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.644 0.259 . . . . 73.51 110.477 -178.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . 0.43 HD11 ' HD3' ' A' ' 485' ' ' LYS . 5.1 mp -131.44 150.96 51.95 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.355 0.598 . . . . 53.55 111.194 -179.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.585 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 5.8 tmmm? -129.6 107.78 9.71 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.95 -1.023 . . . . 73.31 108.517 173.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.93 35.28 26.16 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.036 -0.529 . . . . 74.24 111.328 -176.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 95.96 -20.91 47.85 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.952 -0.642 . . . . 75.21 112.735 178.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 62.1 t -85.02 122.84 38.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 N-CA-C 110.225 -0.287 . . . . 74.55 110.225 -177.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -69.06 132.18 46.21 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.344 -0.389 . . . . 75.41 110.651 178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 79.9 mt -87.11 104.72 16.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.83 -0.623 . . . . 51.23 110.07 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 9.7 t -69.64 160.94 30.65 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.304 0.573 . . . . 63.42 111.206 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . 0.606 ' HA ' HG23 ' A' ' 498' ' ' THR . 0.0 OUTLIER -117.84 -3.45 11.21 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.624 -0.717 . . . . 75.3 109.5 179.689 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -60.82 -39.18 88.01 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 115.253 -0.885 . . . . 61.14 110.397 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . 0.423 ' O ' ' HG3' ' A' ' 497' ' ' GLU . 8.1 pt-20 -127.55 108.26 10.64 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.101 -0.704 . . . . 62.2 109.101 167.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.606 HG23 ' HA ' ' A' ' 495' ' ' ARG . 0.7 OUTLIER -122.29 88.0 2.85 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.389 0.614 . . . . 64.5 111.235 -176.593 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -100.91 -27.4 13.33 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.42 -0.809 . . . . 62.14 109.078 175.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -95.43 -47.32 6.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.208 -0.906 . . . . 65.33 111.026 -177.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.455 ' O ' ' HD2' ' A' ' 502' ' ' ARG . 13.8 m-85 -103.21 148.41 25.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.2 -0.455 . . . . 74.31 110.622 -176.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' ARG . . . . . 0.455 ' HD2' ' O ' ' A' ' 501' ' ' TYR . 1.5 mpt_? -132.58 137.69 47.17 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.558 -0.534 . . . . 75.33 109.558 171.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -111.94 118.55 35.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.654 0.264 . . . . 72.15 110.799 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 1.4 mptm? -111.83 145.37 39.56 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.68 0.276 . . . . 72.13 110.354 176.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -123.35 117.57 25.52 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.318 -0.401 . . . . 62.41 110.787 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . 0.472 ' HB2' ' HG3' ' A' ' 509' ' ' ARG . 42.2 m-20 -121.27 77.7 1.35 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.631 -0.507 . . . . 73.23 109.631 173.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 64.84 -109.26 2.75 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.648 -0.786 . . . . 43.41 112.034 -178.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -85.91 -24.66 26.52 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.769 -0.254 . . . . 71.01 111.091 -177.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.608 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 29.6 ptt180 -92.95 132.41 37.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.616 0.722 . . . . 54.21 110.93 -177.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -114.94 143.98 44.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.519 -0.764 . . . . 72.44 109.28 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 25.6 m-70 -119.22 127.62 53.44 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.844 -0.343 . . . . 71.14 110.803 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.412 HD11 ' HB3' ' A' ' 501' ' ' TYR . 65.4 tp -107.03 102.94 12.25 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.363 -0.977 . . . . 70.42 108.363 168.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.625 HD13 ' HG2' ' A' ' 472' ' ' GLU . 5.8 tp -103.47 115.46 45.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.518 0.675 . . . . 63.2 110.242 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.52 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 34.0 mt -95.27 112.74 28.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.631 -0.713 . . . . 53.21 109.221 177.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -73.76 -43.12 59.97 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.076 0.465 . . . . 73.34 110.048 -176.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -128.67 108.54 10.57 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.548 -0.751 . . . . 73.21 109.519 177.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.403 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -91.48 138.23 31.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.109 -0.496 . . . . 53.14 110.25 -179.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 26.5 mmt -118.84 175.18 5.87 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.203 -0.453 . . . . 61.21 110.012 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.414 HD22 ' H ' ' A' ' 519' ' ' LEU . 3.0 mm? -64.99 -53.91 38.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.34 -0.391 . . . . 64.34 111.089 -173.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -80.01 -18.5 50.08 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.128 0.49 . . . . 73.11 110.716 -178.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -70.29 -33.34 71.45 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.048 -0.524 . . . . 64.25 111.755 -177.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.554 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -64.4 -44.5 91.08 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.865 0.32 . . . . 71.11 111.865 -175.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . 0.585 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 40.47 -157.55 0.03 OUTLIER Glycine 0 CA--C 1.525 0.673 0 O-C-N 123.911 0.757 . . . . 43.22 114.818 175.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 53.7 m80 -105.88 112.45 25.51 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.471 -0.937 . . . . 72.42 108.471 169.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -85.45 131.45 34.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.259 0.552 . . . . 71.44 111.262 -175.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.28 131.42 34.4 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.301 -0.863 . . . . 75.12 110.558 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.6 HD11 ' HB ' ' A' ' 484' ' ' VAL . 37.3 tp -99.62 115.16 28.77 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.438 -0.578 . . . . 74.23 109.438 175.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 485' ' ' LYS . 48.4 t -100.16 112.87 25.2 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.702 -0.481 . . . . 74.33 109.702 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.522 ' C ' ' H ' ' A' ' 531' ' ' GLY . 61.2 p -111.51 -165.0 0.95 Allowed 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.886 -0.597 . . . . 70.3 110.625 -178.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 11.9 m -51.09 6.06 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 124.611 1.164 . . . . 73.5 113.961 171.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . 0.522 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.42 28.88 1.54 Allowed Glycine 0 C--N 1.332 0.348 0 O-C-N 121.952 -0.467 . . . . 53.34 113.253 -175.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -113.4 141.76 17.1 Favored Glycine 0 N--CA 1.448 -0.53 0 N-CA-C 109.974 -1.25 . . . . 74.32 109.974 167.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.4 tp60 -128.84 121.96 29.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.461 0.63 . . . . 63.11 112.096 -173.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -131.14 132.16 44.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.581 -0.736 . . . . 55.13 109.274 170.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -118.81 124.38 47.05 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.032 -0.358 . . . . 61.11 110.032 -176.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.694 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -118.69 159.13 24.2 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.136 -0.484 . . . . 52.31 110.215 178.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -127.36 123.12 35.51 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.92 0.391 . . . . 72.13 110.815 -176.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.565 HD12 ' HA ' ' A' ' 464' ' ' LEU . 54.8 tp -112.12 121.48 45.08 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.878 -0.601 . . . . 75.22 109.723 176.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.658 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.5 mp -108.26 107.66 23.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 109.016 -0.735 . . . . 74.54 109.016 176.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.56 ' HA ' ' O ' ' A' ' 465' ' ' VAL . 42.2 t -94.79 122.82 46.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-O 121.32 0.581 . . . . 74.32 110.37 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . 0.474 ' HB3' ' HE3' ' A' ' 543' ' ' LYS . 7.5 mt-30 -114.64 160.54 19.21 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.98 -1.009 . . . . 74.31 110.166 -176.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . 0.419 ' HG2' HG21 ' A' ' 467' ' ' VAL . 46.6 mt-10 -105.95 106.76 17.42 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.949 -0.76 . . . . 64.44 108.949 174.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . 0.474 ' HE3' ' HB3' ' A' ' 541' ' ' GLN . 17.2 ptpt . . . . . 0 C--O 1.245 0.854 0 CA-C-N 116.293 -0.412 . . . . 42.34 110.137 -177.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.781 0 N-CA-C 111.918 -0.473 . . . . 53.41 111.918 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 5.7 m -111.15 148.16 33.35 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.617 -0.512 . . . . 63.25 109.617 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 57.0 p-80 -65.05 119.96 11.76 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.059 -0.719 . . . . 62.24 109.059 173.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 21.6 ptm -69.55 138.35 88.62 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 116.181 -0.463 . . . . 74.41 111.166 -174.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.83 132.9 22.49 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.21 1.94 . . . . 74.41 109.656 168.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.538 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 55.1 t -68.52 106.69 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 120.889 0.376 . . . . 53.34 110.158 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 52.6 tp -87.64 138.75 31.2 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.943 -0.571 . . . . 73.4 110.348 -178.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.479 HD13 HD23 ' A' ' 527' ' ' LEU . 32.7 mt -91.75 113.3 26.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.563 -0.744 . . . . 71.23 109.458 178.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . 0.453 ' OG1' ' HB2' ' A' ' 476' ' ' GLU . 28.6 p -77.29 -45.86 24.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.929 0.395 . . . . 74.03 110.808 -176.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.46 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 12.1 tpt180 -92.1 111.03 48.09 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.994 -0.548 . . . . 61.33 109.857 176.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_exo -68.81 149.67 73.01 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.491 2.127 . . . . 65.14 111.109 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.781 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 4.0 mm? -66.2 158.94 27.51 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.316 -0.402 . . . . 75.42 110.792 -178.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . 0.528 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 1.8 mp0 -65.12 144.41 57.25 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.97 0.891 . . . . 44.25 112.709 -172.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -104.77 9.13 35.07 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 114.049 -1.432 . . . . 74.33 111.729 -174.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . 0.505 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -121.44 154.36 36.65 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 122.214 1.006 . . . . 73.41 112.894 -160.256 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.494 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.1 pt? -90.86 147.08 23.41 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 113.4 -1.727 . . . . 64.31 112.206 -167.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.556 HG23 HG22 ' A' ' 540' ' ' VAL . 27.4 m -126.68 178.0 4.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.45 -0.795 . . . . 71.42 110.076 175.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . 0.405 ' HB3' ' HG3' ' A' ' 543' ' ' LYS . 51.4 mtm -118.16 158.65 24.69 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.245 -0.434 . . . . 64.25 110.82 -178.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 51.4 t -50.95 128.6 8.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.653 -0.703 . . . . 72.12 111.72 -176.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 89.39 -16.04 57.06 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 115.838 -0.619 . . . . 72.05 113.337 174.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -83.17 135.09 34.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 117.038 0.419 . . . . 74.55 110.792 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . 0.538 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 2.0 ptm180 -66.33 126.52 29.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.63 -0.714 . . . . 70.3 110.61 175.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.506 ' HB ' HG11 ' A' ' 465' ' ' VAL . 5.2 p -113.16 137.94 44.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 109.749 -0.463 . . . . 72.34 109.749 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.467 ' HB2' ' NH2' ' A' ' 470' ' ' ARG . 30.4 tt0 -120.49 124.02 44.39 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.785 -0.643 . . . . 72.32 110.515 -173.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.528 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 97.4 m-85 -110.28 141.07 43.78 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.905 -0.589 . . . . 71.13 109.557 176.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -119.2 134.97 54.9 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.903 0.382 . . . . 73.01 110.234 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 27.1 p -146.93 126.55 13.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.368 -0.378 . . . . 61.22 110.392 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.46 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 31.4 mt-10 -110.77 137.66 48.14 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.82 -0.807 . . . . 75.03 108.82 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 508' ' ' GLN . 27.8 m -119.48 152.63 22.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 C-N-CA 120.562 -0.455 . . . . 71.43 110.653 177.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 16.1 m -66.68 -26.04 66.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.66 -0.7 . . . . 61.45 111.718 -175.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . 0.423 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 37.8 tt0 -106.42 118.18 35.98 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.865 -0.42 . . . . 70.53 109.865 -178.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . 0.826 ' HB3' ' HG2' ' A' ' 508' ' ' GLN . 10.0 pt-20 -76.19 134.34 39.92 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.093 0.473 . . . . 73.45 110.893 -179.125 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 72.68 21.18 79.78 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.696 -0.684 . . . . 63.5 112.092 -176.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.423 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -73.28 150.84 41.64 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.88 0.372 . . . . 74.3 111.452 -179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -81.72 114.53 20.44 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.551 -0.75 . . . . 52.02 110.438 178.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.582 HG12 HG22 ' A' ' 529' ' ' THR . 21.2 m -125.84 150.64 31.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.905 -0.589 . . . . 70.45 109.862 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . 0.508 ' HE2' HD11 ' A' ' 487' ' ' LEU . 21.0 ptmt -125.61 140.44 52.73 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.065 0.459 . . . . 74.23 110.749 177.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -102.01 125.78 48.78 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.621 -0.718 . . . . 72.22 110.222 -179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . 0.508 HD11 ' HE2' ' A' ' 485' ' ' LYS . 5.7 mp -114.13 136.4 52.98 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.063 -0.517 . . . . 55.01 110.379 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.15 105.46 12.62 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.813 -1.181 . . . . 72.14 107.813 174.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 57.12 34.04 24.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.993 -0.549 . . . . 64.45 110.691 -174.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.25 -18.88 56.65 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.001 -0.619 . . . . 44.34 112.906 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 45.5 t -83.09 127.45 39.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 110.328 -0.249 . . . . 50.13 110.328 -178.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -72.24 126.56 30.12 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.47 -0.567 . . . . 73.41 109.47 178.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.472 HD11 ' HE2' ' A' ' 525' ' ' TYR . 77.3 mt -66.04 106.43 1.61 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.141 0.496 . . . . 74.22 110.641 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 9.8 t -73.45 141.52 46.87 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 115.586 -0.734 . . . . 74.25 110.751 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . 0.466 ' N ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -107.7 13.12 26.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.694 -0.685 . . . . 73.13 110.264 -179.04 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -59.96 -56.61 19.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.8 -0.637 . . . . 60.34 109.644 174.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -137.78 118.39 13.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.729 -0.668 . . . . 75.4 109.913 173.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.2 108.56 5.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.076 -0.511 . . . . 72.21 110.42 -178.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -104.47 -22.22 13.33 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.284 0.564 . . . . 74.23 110.098 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -92.87 -34.47 13.81 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.744 -0.662 . . . . 73.11 111.611 -177.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.412 ' HD1' HG12 ' A' ' 514' ' ' ILE . 8.0 m-85 -115.77 141.51 48.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.617 -0.265 . . . . 73.03 110.309 -174.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 70.4 mtp180 -132.52 126.42 32.86 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.87 0.366 . . . . 74.21 110.128 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -96.43 113.63 25.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.803 -0.635 . . . . 71.31 110.819 -174.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 42.1 mttm -109.64 124.41 51.13 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.101 -0.5 . . . . 60.03 111.246 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -103.92 111.15 23.57 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.022 -0.535 . . . . 75.31 109.984 177.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . 0.401 ' O ' ' HG2' ' A' ' 509' ' ' ARG . 4.9 m-20 -120.03 87.09 2.68 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.124 0.488 . . . . 72.51 110.2 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 63.4 -105.51 1.08 Allowed Glycine 0 N--CA 1.449 -0.448 0 CA-C-N 115.638 -0.71 . . . . 71.42 112.843 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.826 ' HG2' ' HB3' ' A' ' 480' ' ' GLU . 18.5 mt-30 -93.1 -25.18 18.01 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.767 0.318 . . . . 65.1 110.871 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.401 ' HG2' ' O ' ' A' ' 506' ' ' ASP . 16.9 ptp180 -96.43 153.4 17.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.352 0.596 . . . . 73.23 111.002 -175.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -127.1 123.06 35.98 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.72 -0.673 . . . . 64.31 109.268 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 56.3 m-70 -101.52 118.3 36.67 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.989 -0.374 . . . . 71.21 109.989 -177.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 61.5 tp -104.29 106.69 17.28 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.265 -0.642 . . . . 74.43 109.265 173.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 9.2 tp -104.92 128.77 58.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.992 -0.549 . . . . 75.14 110.133 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 34.2 mt -104.54 114.3 43.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.204 -0.665 . . . . 53.25 109.204 175.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -58.23 -52.64 64.74 Favored 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.547 0.529 . . . . 44.51 111.435 -176.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -137.74 109.64 7.17 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.722 -0.473 . . . . 73.35 109.722 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -76.19 127.38 32.8 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.953 -0.567 . . . . 71.02 111.238 -178.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 14.9 mmt -97.51 175.43 6.22 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.836 -0.62 . . . . 60.15 109.678 176.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.2 -53.36 25.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.952 0.406 . . . . 72.35 110.805 -178.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -71.32 -27.89 63.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.072 -0.513 . . . . 73.11 111.034 -177.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -77.83 -3.44 41.53 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.516 -0.766 . . . . 52.32 111.857 -173.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.55 ' HA ' HD23 ' A' ' 538' ' ' LEU . . . -74.37 -43.2 57.54 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.498 -0.481 . . . . 52.5 109.918 177.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 38.28 -158.55 0.01 OUTLIER Glycine 0 C--N 1.339 0.734 0 O-C-N 124.457 1.098 . . . . 44.3 115.557 172.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -114.05 108.86 17.57 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.307 -0.627 . . . . 73.52 109.307 169.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . 0.472 ' HE2' HD11 ' A' ' 493' ' ' LEU . 32.1 m-85 -85.63 133.86 34.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.964 0.411 . . . . 73.41 111.087 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -134.35 128.78 34.38 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.924 -0.58 . . . . 64.44 110.545 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.479 HD23 HD13 ' A' ' 456' ' ' ILE . 63.4 tp -99.86 111.98 24.27 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.84 -0.43 . . . . 73.52 109.84 176.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 70.8 m -104.79 126.08 51.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.299 0.571 . . . . 55.25 110.914 -179.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.582 HG22 HG12 ' A' ' 484' ' ' VAL . 30.1 p -115.79 -165.52 1.05 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.341 -0.845 . . . . 72.41 110.119 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . 0.466 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 14.7 m -50.77 7.43 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.859 1.264 . . . . 73.32 114.173 171.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . 0.535 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 122.14 28.18 1.55 Allowed Glycine 0 C--N 1.331 0.266 0 O-C-N 122.007 -0.433 . . . . 54.33 113.245 -174.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -117.76 138.37 13.96 Favored Glycine 0 N--CA 1.448 -0.535 0 N-CA-C 109.603 -1.399 . . . . 12.41 109.603 163.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -129.35 127.92 42.04 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 117.463 0.632 . . . . 73.31 112.103 -171.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -136.62 136.45 39.18 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 115.485 -0.78 . . . . 74.11 109.551 171.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 33.3 tp -109.09 145.24 36.0 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.817 0.341 . . . . 62.21 111.029 -176.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.781 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -123.72 132.46 53.82 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.092 -0.504 . . . . 71.44 110.324 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -110.41 115.92 30.51 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 109.77 -0.456 . . . . 71.34 109.77 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.555 HD11 HG22 ' A' ' 465' ' ' VAL . 35.7 tp -108.64 121.07 44.25 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.058 -0.519 . . . . 75.11 109.723 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 539' ' ' ILE . 4.5 mp -109.98 116.64 52.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.228 -0.656 . . . . 73.13 109.228 177.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.556 HG22 HG23 ' A' ' 465' ' ' VAL . 90.1 t -114.1 128.44 71.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.92 0.391 . . . . 72.02 110.257 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.46 169.65 14.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.048 -0.524 . . . . 62.34 109.894 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -77.53 141.31 39.67 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.532 -0.758 . . . . 72.32 110.642 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . 0.449 ' HE3' ' HB2' ' A' ' 543' ' ' LYS . 33.2 mtmt . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.398 -0.811 . . . . 72.2 110.033 176.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.621 0 N-CA-C 111.818 -0.513 . . . . 53.14 111.818 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 21.5 p -135.25 142.89 46.03 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 110.188 -0.301 . . . . 73.34 110.188 178.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -79.8 111.98 16.64 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.785 -0.45 . . . . 61.32 109.785 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . 0.462 ' HA ' ' HD3' ' A' ' 453' ' ' PRO . 23.6 ptm -66.05 126.88 92.69 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.928 -0.578 . . . . 74.32 111.394 -176.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 452' ' ' MET . 1.4 Cg_endo -84.76 159.77 12.13 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 C-N-CA 122.798 2.332 . . . . 73.11 110.391 170.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.554 ' HB ' ' HB ' ' A' ' 529' ' ' THR . 58.5 t -78.18 107.35 10.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 108.979 -0.749 . . . . 62.12 108.979 178.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . 0.428 ' O ' ' HA ' ' A' ' 477' ' ' VAL . 62.0 tp -84.91 124.17 31.34 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.733 -0.667 . . . . 73.32 110.753 -173.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.524 HD13 HD23 ' A' ' 527' ' ' LEU . 29.3 mt -91.01 98.9 8.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.71 -0.677 . . . . 72.42 109.998 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 33.8 p -79.19 -16.04 57.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.117 0.484 . . . . 72.44 111.088 -176.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.474 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 19.2 tpt85 -130.38 102.03 17.21 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 115.904 -0.589 . . . . 72.44 109.717 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 458' ' ' ARG . 29.7 Cg_endo -63.62 167.73 12.89 Favored 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 123.224 2.616 . . . . 74.4 112.078 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.799 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 3.2 mm? -71.1 172.59 8.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.077 -0.51 . . . . 73.41 110.906 -177.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . 0.906 ' HG2' ' HA ' ' A' ' 473' ' ' PHE . 13.5 mm-40 -67.78 152.8 45.0 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.787 -0.642 . . . . 71.33 112.488 -176.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -105.53 6.51 32.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.315 -0.857 . . . . 70.43 112.454 -175.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . 0.402 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 0.1 OUTLIER -123.7 154.53 39.29 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.89 0.852 . . . . 71.44 113.008 -162.133 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.653 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.0 pt? -103.9 146.84 28.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.185 -1.37 . . . . 74.52 111.808 -170.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.567 HG11 ' HB ' ' A' ' 471' ' ' VAL . 27.5 m -123.71 178.87 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-O 121.079 0.466 . . . . 44.31 111.265 -177.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 10.4 mtm -112.32 161.61 16.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.377 -0.374 . . . . 65.4 111.295 -178.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . 0.48 HG21 ' HG2' ' A' ' 542' ' ' GLU . 59.6 t -56.72 129.67 18.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 CA-C-N 115.955 -0.566 . . . . 52.35 112.178 -176.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 86.12 7.7 79.86 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.72 -0.673 . . . . 75.41 113.208 174.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -116.73 133.01 56.53 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.799 0.299 . . . . 63.35 110.306 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . 0.579 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 5.3 ptm180 -74.02 131.86 41.8 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.301 0.572 . . . . 72.5 112.1 -175.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.567 ' HB ' HG11 ' A' ' 465' ' ' VAL . 7.5 p -115.37 146.33 19.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.205 -0.907 . . . . 71.55 109.714 176.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 64.8 tt0 -123.03 129.17 51.16 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.381 -0.229 . . . . 75.12 110.381 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.906 ' HA ' ' HG2' ' A' ' 461' ' ' GLU . 96.0 m-85 -106.45 124.89 50.29 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.437 -0.579 . . . . 74.45 109.437 174.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -100.25 131.48 46.16 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.085 -0.339 . . . . 73.03 110.085 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.452 ' HB3' HD13 ' A' ' 460' ' ' LEU . 18.2 p -141.4 118.05 10.98 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.091 0.472 . . . . 45.42 110.555 177.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.637 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 39.7 mt-10 -107.39 138.58 43.33 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.853 -0.612 . . . . 71.42 109.747 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 455' ' ' LEU . 28.2 m -132.57 174.06 13.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-N 116.297 -0.411 . . . . 71.12 110.767 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 16.7 p -85.77 8.37 20.2 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.482 0.549 . . . . 74.3 112.482 -175.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . 0.56 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 41.2 tt0 -126.82 134.83 50.46 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.6 0.238 . . . . 64.31 110.631 -177.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . 0.512 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 0.4 OUTLIER -81.83 128.27 33.85 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.555 -0.535 . . . . 73.23 109.555 179.15 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 60.27 32.79 77.89 Favored Glycine 0 N--CA 1.448 -0.502 0 C-N-CA 120.165 -1.017 . . . . 62.55 110.879 -171.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.56 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -50.71 141.67 12.5 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 113.145 0.794 . . . . 75.51 113.145 -174.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -74.79 103.7 5.14 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.126 -0.943 . . . . 73.3 109.813 175.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.559 ' HB ' HD11 ' A' ' 527' ' ' LEU . 34.3 m -121.51 150.11 24.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.931 -0.577 . . . . 73.22 110.836 -177.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 47.1 tttp -123.27 126.86 47.7 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.213 -0.662 . . . . 73.21 109.213 179.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . 0.461 ' HB3' HD12 ' A' ' 493' ' ' LEU . 95.3 m95 -101.39 125.29 48.01 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.605 -0.27 . . . . 62.12 110.638 -177.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . 0.441 HD13 ' SG ' ' A' ' 528' ' ' CYS . 6.5 mp -128.12 144.07 51.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.065 0.459 . . . . 75.41 110.77 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.481 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 5.8 tmmm? -124.19 106.78 10.58 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.363 -0.977 . . . . 65.14 108.363 174.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 52.21 36.01 18.23 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 123.749 0.656 . . . . 73.24 111.693 -175.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.02 -20.07 51.73 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.869 -0.681 . . . . 34.01 112.921 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 43.4 t -86.64 123.79 39.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 110.092 -0.336 . . . . 63.44 110.092 -179.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -70.6 134.28 47.47 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.094 0.473 . . . . 70.03 110.804 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.461 HD12 ' HB3' ' A' ' 486' ' ' TRP . 52.2 mt -82.73 103.22 12.07 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.767 -0.651 . . . . 74.52 109.411 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 7.0 t -65.15 145.52 56.17 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 73.1 111.631 -177.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.62 9.5 17.88 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.149 -0.932 . . . . 70.22 109.482 176.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.32 -44.41 16.24 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.723 -0.671 . . . . 72.2 110.04 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 497' ' ' GLU . 7.0 pt-20 -143.16 110.08 5.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.314 0.578 . . . . 73.33 109.573 171.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.544 HG21 ' HB2' ' A' ' 501' ' ' TYR . 0.3 OUTLIER -142.76 109.54 5.47 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.231 0.539 . . . . 61.35 111.381 -177.072 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -89.88 -7.54 53.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.616 -0.72 . . . . 72.02 110.871 177.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . 0.414 ' CG ' ' HB2' ' A' ' 516' ' ' GLU . 3.4 mtmm -114.4 -48.75 2.86 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.048 -0.524 . . . . 64.44 112.054 -173.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.544 ' HB2' HG21 ' A' ' 498' ' ' THR . 57.2 m-85 -93.04 126.77 38.29 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.813 -0.44 . . . . 72.43 109.813 -179.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' ARG . . . . . 0.466 ' HA ' ' HD2' ' A' ' 502' ' ' ARG . 1.2 tpt180 -117.09 123.11 45.99 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.234 -0.654 . . . . 63.24 109.234 177.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -104.13 117.46 34.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.236 -0.438 . . . . 64.5 110.228 -174.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 57.2 mttm -114.35 131.56 56.51 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.35 -0.386 . . . . 54.02 110.576 -178.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -103.9 118.27 36.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.196 -0.456 . . . . 73.14 110.687 -179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -120.42 89.92 3.22 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.104 -0.498 . . . . 62.45 110.016 174.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 61.68 -101.45 0.35 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.637 -0.71 . . . . 74.52 112.518 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.512 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 26.5 mt-30 -98.88 -20.23 16.94 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.524 0.202 . . . . 74.52 111.376 -177.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.637 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 14.7 ptt180 -101.04 153.54 19.46 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.333 0.587 . . . . 73.45 111.585 -175.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -121.99 141.37 51.41 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.424 -0.807 . . . . 75.53 109.494 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . 0.555 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 15.3 m-70 -110.6 133.26 53.47 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 110.02 -0.363 . . . . 64.02 110.02 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 66.6 tp -107.51 104.19 13.69 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.739 -0.467 . . . . 64.32 109.739 172.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.483 HD13 ' HD2' ' A' ' 504' ' ' LYS . 1.9 mp -100.91 127.7 53.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.065 -0.516 . . . . 53.33 110.092 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.579 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 53.7 mt -108.1 112.37 39.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.743 -0.466 . . . . 73.33 109.743 174.709 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -72.44 -44.45 62.37 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.195 -0.457 . . . . 45.43 111.144 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . 0.414 ' HB2' ' CG ' ' A' ' 500' ' ' LYS . 31.8 mt-10 -116.2 107.52 14.99 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.591 -0.522 . . . . 60.33 109.591 -178.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -94.2 113.21 25.09 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 116.383 -0.371 . . . . 61.45 110.47 -179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . 0.453 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 25.0 mmt -110.7 164.8 12.39 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.166 -0.47 . . . . 62.44 110.281 178.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.541 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.1 mm? -61.37 -55.41 31.89 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.326 -0.397 . . . . 72.05 111.529 -172.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -82.99 -8.04 59.6 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.104 -0.498 . . . . 74.24 111.528 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 9.2 t70 -82.28 -27.26 32.48 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.312 -0.404 . . . . 70.11 110.521 -175.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.677 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -63.27 -41.73 99.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.217 -0.447 . . . . 73.4 111.614 -177.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . 0.481 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 42.48 -158.2 0.07 OUTLIER Glycine 0 CA--C 1.526 0.742 0 O-C-N 123.783 0.677 . . . . 51.3 114.422 176.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 65.9 m80 -109.6 115.69 30.36 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.007 -0.738 . . . . 65.14 109.007 172.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -89.48 131.67 35.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.349 0.595 . . . . 73.35 111.145 -176.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.94 125.48 33.55 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.434 -0.803 . . . . 71.53 110.186 178.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.559 HD11 ' HB ' ' A' ' 484' ' ' VAL . 44.6 tp -92.55 112.32 24.23 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.478 -0.564 . . . . 51.33 109.478 177.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . 0.441 ' SG ' HD13 ' A' ' 487' ' ' LEU . 62.2 m -107.42 114.89 29.2 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.882 -0.599 . . . . 74.02 110.321 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.571 ' C ' ' H ' ' A' ' 531' ' ' GLY . 72.2 p -109.89 -165.39 1.0 Allowed 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.054 -0.521 . . . . 73.23 109.874 178.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . 0.464 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 20.3 m -48.6 6.65 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.742 1.217 . . . . 64.25 114.18 171.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . 0.571 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.44 26.62 1.95 Allowed Glycine 0 N--CA 1.451 -0.356 0 O-C-N 122.092 -0.38 . . . . 63.2 112.949 -176.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -110.45 144.38 17.08 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 109.406 -1.477 . . . . 64.24 109.406 163.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.58 132.39 48.21 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 117.83 0.815 . . . . 73.15 111.613 -171.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -141.12 128.59 21.25 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.697 -0.683 . . . . 62.35 109.451 172.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.425 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.7 tm? -114.8 131.95 56.64 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 110.101 -0.333 . . . . 62.55 110.101 -174.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.799 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -128.95 158.17 39.57 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.53 -0.305 . . . . 71.04 110.583 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -131.9 117.49 18.55 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.533 -0.303 . . . . 54.43 110.19 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.513 HD11 HG22 ' A' ' 465' ' ' VAL . 37.3 tp -106.1 128.71 54.07 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.979 -0.555 . . . . 74.2 109.831 178.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.653 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.3 mp -117.89 108.7 25.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 109.365 -0.605 . . . . 64.43 109.365 177.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.677 HG23 ' HB2' ' A' ' 522' ' ' ALA . 66.9 t -90.64 132.37 35.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 N-CA-C 109.784 -0.45 . . . . 51.44 109.784 178.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -120.89 157.9 28.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.815 -0.63 . . . . 73.23 110.333 -175.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . 0.541 ' HG3' HD11 ' A' ' 519' ' ' LEU . 39.0 mt-10 -107.9 117.77 35.0 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.967 -0.561 . . . . 64.32 110.38 176.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . 0.877 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 9.6 mmpt? . . . . . 0 C--O 1.246 0.875 0 CA-C-O 118.31 -0.852 . . . . 52.43 109.58 171.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.629 0 N-CA-C 111.944 -0.463 . . . . 70.05 111.944 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 26.3 t -98.68 142.45 30.23 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 110.35 -0.241 . . . . 72.44 110.35 -179.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -102.64 -35.91 8.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.098 0.475 . . . . 71.51 110.341 178.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 51.3 ttp -94.86 109.66 45.28 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.358 -0.837 . . . . 50.11 110.177 -179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -72.3 132.75 19.84 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 121.883 1.722 . . . . 71.23 111.136 177.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.476 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 83.0 t -67.08 111.51 2.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.064 0.459 . . . . 71.1 110.065 178.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 60.1 tp -91.22 148.63 22.22 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.498 -0.773 . . . . 62.4 110.344 -176.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.541 HD13 HD23 ' A' ' 527' ' ' LEU . 25.2 mt -94.79 99.52 9.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 109.232 -0.655 . . . . 65.3 109.232 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 12.5 p -70.02 -34.51 73.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.006 -0.543 . . . . 73.33 110.904 -176.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 458' ' ' ARG . 3.1 tpp180 -116.77 105.52 49.6 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 116.03 -0.532 . . . . 72.24 109.937 174.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -66.55 168.86 15.45 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.193 2.595 . . . . 74.12 111.254 175.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.67 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 2.5 mm? -65.0 153.59 40.22 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.811 -0.44 . . . . 62.3 109.811 -178.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . 0.434 ' HB3' HE22 ' A' ' 463' ' ' GLN . 2.6 tp10 -66.37 152.99 43.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.412 0.625 . . . . 71.44 111.652 -170.044 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -92.02 9.01 35.03 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 113.816 1.043 . . . . 73.31 113.816 -167.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . 0.434 HE22 ' HB3' ' A' ' 461' ' ' GLU . 0.0 OUTLIER -123.13 153.86 39.41 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 119.572 -0.851 . . . . 75.22 112.109 -166.37 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.72 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.3 pt? -118.02 144.9 45.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.291 -1.322 . . . . 62.13 110.798 -170.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.401 HG11 ' HB ' ' A' ' 471' ' ' VAL . 31.2 m -117.71 177.64 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.225 0.536 . . . . 61.52 112.131 -174.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.81 171.12 9.07 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.543 -0.753 . . . . 50.51 110.707 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . 0.553 HG21 ' HG2' ' A' ' 542' ' ' GLU . 46.8 t -59.67 125.81 16.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.211 -0.449 . . . . 51.11 111.32 178.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 81.96 3.4 90.59 Favored Glycine 0 CA--C 1.517 0.201 0 CA-C-N 115.889 -0.596 . . . . 63.1 113.065 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -96.01 136.99 35.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.752 0.311 . . . . 74.14 110.608 -179.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . 0.48 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 1.5 ptm180 -66.84 146.69 54.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.824 -0.625 . . . . 74.32 111.377 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.401 ' HB ' HG11 ' A' ' 465' ' ' VAL . 7.7 p -147.38 137.94 17.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.579 -0.737 . . . . 72.22 109.643 175.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.52 ' HG3' HG13 ' A' ' 513' ' ' ILE . 13.0 mp0 -107.68 130.96 54.88 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.871 0.367 . . . . 63.32 110.559 178.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.588 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 57.8 m-85 -108.07 113.21 26.2 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.574 -0.528 . . . . 72.33 109.574 170.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -95.81 132.45 41.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.649 -0.705 . . . . 62.2 110.388 -176.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 458' ' ' ARG . 7.0 p -141.29 118.54 11.38 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.875 0.369 . . . . 73.2 110.613 177.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.993 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 23.4 mt-10 -112.16 138.24 49.12 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.527 -0.545 . . . . 62.44 109.527 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.492 HG21 ' HB3' ' A' ' 482' ' ' ALA . 26.2 m -122.6 173.12 8.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.578 -0.283 . . . . 64.4 111.304 -178.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 15.4 m -61.61 -36.27 80.26 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 113.152 0.797 . . . . 41.34 113.152 -175.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -119.72 156.25 30.89 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.421 -0.215 . . . . 72.1 110.421 -172.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . 0.483 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 0.1 OUTLIER -86.34 143.72 27.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.095 0.474 . . . . 62.43 110.563 -179.005 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 72.62 3.38 58.57 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.821 -0.704 . . . . 71.33 112.733 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.492 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -56.07 134.38 52.59 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.845 0.355 . . . . 73.43 110.959 -179.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -78.09 139.3 39.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.748 -0.66 . . . . 44.13 110.058 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.6 ' HB ' HD11 ' A' ' 527' ' ' LEU . 20.1 m -127.44 150.58 33.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.049 0.452 . . . . 72.3 110.875 -178.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . 0.552 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 65.4 tttp -108.2 122.09 46.2 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.608 -0.724 . . . . 73.32 109.378 179.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . 0.54 ' HB3' HD12 ' A' ' 493' ' ' LEU . 59.1 m95 -101.34 122.22 43.32 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.945 0.403 . . . . 75.32 110.623 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . 0.456 HD11 ' HE3' ' A' ' 485' ' ' LYS . 86.0 mt -130.15 139.08 50.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.865 -0.607 . . . . 63.04 111.34 -176.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.628 ' O ' HG12 ' A' ' 491' ' ' VAL . 3.7 tmmm? -115.3 106.52 14.13 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.085 -1.08 . . . . 73.31 108.085 168.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 51.79 34.37 13.06 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.162 -0.472 . . . . 63.03 111.253 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 99.42 -14.57 60.78 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.807 -0.711 . . . . 44.32 114.015 175.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . 0.628 HG12 ' O ' ' A' ' 488' ' ' LYS . 6.2 p -87.89 139.72 16.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-N 117.862 0.831 . . . . 51.03 110.559 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -66.59 124.18 22.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.986 -0.552 . . . . 75.2 111.567 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.54 HD12 ' HB3' ' A' ' 486' ' ' TRP . 94.1 mt -84.15 106.81 16.08 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.921 -0.77 . . . . 73.35 108.921 171.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 5.5 t -64.39 129.09 38.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.331 0.586 . . . . 74.43 111.656 -174.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.16 3.01 18.16 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.587 -0.733 . . . . 73.13 110.455 176.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -59.6 -54.27 48.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.099 -0.5 . . . . 72.02 109.954 173.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -149.34 111.62 4.68 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.609 -0.723 . . . . 53.45 109.833 174.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.448 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.2 OUTLIER -124.6 125.83 44.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.061 -0.518 . . . . 71.3 110.229 -178.119 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -94.81 -42.08 8.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.452 0.644 . . . . 73.4 110.17 -178.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -80.17 -44.25 20.17 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.318 -0.856 . . . . 65.13 110.895 -173.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.448 ' O ' ' HB ' ' A' ' 498' ' ' THR . 5.1 m-85 -104.95 141.82 35.88 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.027 -0.731 . . . . 73.33 109.027 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 21.0 mtp180 -128.26 123.22 33.59 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.111 0.481 . . . . 65.42 109.742 176.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -94.77 127.8 41.03 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.634 -0.712 . . . . 74.32 110.368 -174.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.621 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 1.3 mptm? -114.4 144.85 42.63 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.421 -0.354 . . . . 54.34 110.679 177.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -116.24 130.35 56.74 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.051 -0.522 . . . . 65.41 109.823 177.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . 0.403 ' HB3' ' HG3' ' A' ' 509' ' ' ARG . 27.7 t70 -138.83 86.83 2.17 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.136 0.493 . . . . 75.2 110.06 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 63.7 -104.28 0.83 Allowed Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.899 -0.591 . . . . 52.11 112.551 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.483 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 21.6 mt-30 -95.43 -15.36 23.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.865 0.365 . . . . 73.51 110.797 -176.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.993 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 5.7 ptt180 -106.93 139.58 41.1 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.507 0.67 . . . . 73.25 111.786 -175.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -114.5 143.85 44.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.179 -0.919 . . . . 72.23 108.71 176.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . 0.621 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 84.6 m-70 -118.14 128.0 54.31 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.339 -0.245 . . . . 74.24 110.339 -177.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.588 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 57.7 tp -104.16 103.86 13.7 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 109.793 -0.447 . . . . 73.32 109.793 174.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.52 HG13 ' HG3' ' A' ' 472' ' ' GLU . 1.7 mp -98.23 118.93 45.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.025 -0.534 . . . . 74.23 110.217 177.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.48 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 62.2 mt -100.17 113.2 34.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.813 -0.63 . . . . 62.14 109.659 175.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -75.47 -46.98 29.25 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.102 0.477 . . . . 71.51 110.611 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -121.17 108.33 13.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.727 -0.67 . . . . 71.14 109.629 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.448 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -91.37 117.34 29.58 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.156 -0.475 . . . . 72.42 110.302 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 25.7 mmt -108.14 166.85 10.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.448 -0.342 . . . . 63.32 110.548 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.446 ' H ' HD22 ' A' ' 519' ' ' LEU . 3.3 mm? -57.73 -53.32 59.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 45.3 111.214 -174.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -77.69 -18.04 57.05 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.818 -0.628 . . . . 60.53 110.975 -175.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -80.17 -21.02 43.49 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.106 -0.497 . . . . 71.11 111.831 -174.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.664 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -63.36 -42.85 98.91 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.966 -0.293 . . . . 55.42 110.892 -177.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.23 -158.66 0.06 OUTLIER Glycine 0 C--N 1.335 0.498 0 CA-C-N 115.282 -0.872 . . . . 42.31 114.02 177.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 81.9 m-70 -118.98 108.64 15.0 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.087 -0.709 . . . . 75.41 109.087 170.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . 0.477 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 16.1 m-30 -85.19 132.81 34.23 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.084 -0.507 . . . . 74.5 111.186 -175.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -134.89 119.25 17.84 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.539 -0.755 . . . . 64.41 109.641 176.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.6 HD11 ' HB ' ' A' ' 484' ' ' VAL . 40.9 tp -89.02 117.95 28.4 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.244 -0.434 . . . . 73.41 110.171 -177.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . 0.552 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 70.0 m -104.45 122.88 46.45 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.975 -0.557 . . . . 72.4 109.976 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.555 HG23 HG12 ' A' ' 484' ' ' VAL . 0.2 OUTLIER -116.54 -167.08 1.23 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.889 -0.596 . . . . 74.32 110.275 -175.724 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . 0.454 ' H ' HG22 ' A' ' 529' ' ' THR . 9.9 m -52.11 7.4 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 125.418 1.487 . . . . 60.1 114.082 173.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . 0.546 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.14 26.73 1.99 Allowed Glycine 0 N--CA 1.452 -0.293 0 N-CA-C 111.69 -0.564 . . . . 73.12 111.69 -168.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -123.75 142.29 14.17 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 109.168 -1.573 . . . . 71.44 109.168 165.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.29 121.36 20.03 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 117.701 0.751 . . . . 73.21 110.694 -173.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -118.28 139.08 51.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.174 -0.466 . . . . 44.25 110.745 177.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.411 HD13 ' N ' ' A' ' 536' ' ' ALA . 3.0 tm? -106.61 134.96 48.96 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.568 -0.53 . . . . 72.31 109.568 -177.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.67 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -118.47 152.58 35.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.771 0.32 . . . . 55.51 111.242 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -117.19 116.18 26.77 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.119 -0.492 . . . . 74.32 109.901 175.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.548 HD23 ' HA ' ' A' ' 522' ' ' ALA . 28.1 tp -129.82 115.9 17.92 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.989 0.424 . . . . 64.11 109.878 175.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.479 ' HB ' ' CD1' ' A' ' 464' ' ' LEU . 62.0 mt -126.95 109.05 19.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 N-CA-C 109.333 -0.617 . . . . 73.21 109.333 176.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.664 HG23 ' HB2' ' A' ' 522' ' ' ALA . 79.2 t -89.67 127.83 42.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 N-CA-C 109.284 -0.636 . . . . 50.34 109.284 179.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -126.65 144.3 50.96 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.848 -0.615 . . . . 61.14 110.855 -174.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . 0.553 ' HG2' HG21 ' A' ' 467' ' ' VAL . 37.7 mt-10 -89.2 109.95 20.76 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.115 -0.698 . . . . 71.45 109.115 173.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 58.1 pttt . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.539 -0.743 . . . . 73.02 109.961 -178.433 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.754 0 N-CA-C 112.479 -0.248 . . . . 64.45 112.479 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 48.9 m 64.96 19.83 11.95 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 122.835 0.454 . . . . 71.24 111.606 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 3.2 t-160 -92.62 83.28 4.86 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.447 -0.946 . . . . 60.15 108.447 177.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 23.8 ptm -98.69 138.93 20.79 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 116.122 -0.49 . . . . 64.52 111.378 -172.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -81.22 131.93 7.96 Favored 'Trans proline' 0 N--CA 1.448 -1.165 0 C-N-CA 122.343 2.029 . . . . 54.04 110.214 169.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.55 ' H ' ' HB2' ' A' ' 530' ' ' SER . 98.2 t -74.86 110.27 9.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.817 -0.438 . . . . 71.35 109.817 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 60.4 tp -79.49 129.95 34.95 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.624 -0.716 . . . . 63.44 110.151 -178.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.501 HD13 HD23 ' A' ' 527' ' ' LEU . 42.3 mt -80.27 98.23 3.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 108.884 -0.784 . . . . 70.02 108.884 175.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 35.7 p -69.62 -39.45 77.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.627 -0.715 . . . . 64.0 111.382 -172.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.676 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 6.4 tpt180 -102.81 122.46 45.75 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.843 -0.617 . . . . 74.01 110.5 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -66.43 165.72 23.98 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.87 2.38 . . . . 73.35 112.294 178.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.542 ' CB ' ' HB2' ' A' ' 536' ' ' ALA . 4.1 mm? -80.26 172.01 14.32 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.129 -0.487 . . . . 74.41 111.408 -179.008 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . 0.557 ' HG3' ' OE1' ' A' ' 463' ' ' GLN . 0.3 OUTLIER -69.3 138.31 53.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.495 -0.775 . . . . 72.53 111.561 -175.64 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -104.97 8.56 34.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.983 -1.008 . . . . 70.34 113.321 -169.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . 0.557 ' OE1' ' HG3' ' A' ' 461' ' ' GLU . 0.2 OUTLIER -124.07 152.73 42.34 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 119.54 -0.864 . . . . 72.11 112.151 -168.709 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.585 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 2.3 pt? -100.4 146.43 27.01 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.495 -1.23 . . . . 73.52 111.433 -171.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.527 HG11 ' HB ' ' A' ' 471' ' ' VAL . 27.1 m -117.82 177.09 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.04 0.447 . . . . 71.34 110.508 175.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . 0.405 ' HG2' ' HG3' ' A' ' 543' ' ' LYS . 37.7 mtm -118.18 159.77 22.73 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.001 -0.545 . . . . 74.55 110.135 -177.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . 0.512 HG21 ' HG2' ' A' ' 542' ' ' GLU . 64.8 t -55.27 124.33 8.02 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.285 0 CA-C-O 121.004 0.43 . . . . 72.41 111.495 -174.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.41 -11.96 58.31 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.975 -0.631 . . . . 54.44 112.616 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -102.98 145.3 30.08 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.102 -0.333 . . . . 73.12 110.102 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . 0.504 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 5.4 ptp180 -86.76 135.1 33.49 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.268 0.556 . . . . 73.24 111.649 -177.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.527 ' HB ' HG11 ' A' ' 465' ' ' VAL . 7.1 p -119.1 133.96 64.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.622 -0.717 . . . . 54.23 110.019 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -115.44 127.9 55.66 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.507 -0.315 . . . . 64.11 110.176 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.46 ' HB3' HD12 ' A' ' 460' ' ' LEU . 96.5 m-85 -104.77 115.65 30.67 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.479 -0.563 . . . . 74.14 109.479 177.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -103.42 133.96 47.59 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.234 -0.439 . . . . 62.33 110.046 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 509' ' ' ARG . 20.9 p -149.41 147.56 28.42 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.194 -0.457 . . . . 73.34 110.681 -179.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.676 ' HB2' ' HB3' ' A' ' 458' ' ' ARG . 49.1 mt-10 -123.07 138.75 54.59 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.839 0.352 . . . . 61.35 110.286 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.401 ' O ' ' HB3' ' A' ' 508' ' ' GLN . 18.6 m -113.11 163.3 10.44 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-N 115.928 -0.578 . . . . 74.24 109.742 174.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 11.5 t -60.67 -38.35 84.63 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.162 0.43 . . . . 45.13 112.162 -175.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . 0.553 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 6.6 tp10 -106.98 139.71 40.94 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.255 -0.276 . . . . 71.54 110.255 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.51 134.98 43.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.261 0.553 . . . . 73.12 111.157 -177.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 63.46 19.74 62.66 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.749 -0.66 . . . . 70.33 112.862 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.553 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -62.1 151.56 35.3 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.93 0.395 . . . . 74.21 111.077 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . 0.482 ' CD ' ' H ' ' A' ' 483' ' ' GLN . 0.0 OUTLIER -72.54 118.89 16.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.451 0.643 . . . . 75.14 110.912 179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.634 HG12 HG23 ' A' ' 529' ' ' THR . 34.9 m -127.34 150.66 33.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.299 -0.864 . . . . 62.12 109.508 178.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . 0.562 ' HE2' ' HG3' ' A' ' 492' ' ' GLU . 83.6 tttt -128.31 136.33 50.84 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.768 0.318 . . . . 72.12 110.18 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . 0.563 ' HB3' HD12 ' A' ' 493' ' ' LEU . 90.1 m95 -102.15 125.92 48.97 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.971 0.415 . . . . 72.12 110.814 -176.813 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . 0.533 ' HG ' ' HA ' ' A' ' 492' ' ' GLU . 8.0 mp -126.32 159.53 32.88 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.926 -0.579 . . . . 61.41 110.068 176.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -141.15 116.97 10.39 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.448 -0.575 . . . . 74.33 109.448 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 57.82 34.14 24.04 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.511 0.507 . . . . 65.24 110.614 -175.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 81.98 -10.71 51.67 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-N 115.683 -0.689 . . . . 74.0 112.449 -179.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 40.6 t -86.78 129.98 37.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.869 -0.419 . . . . 74.04 109.869 -178.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . 0.562 ' HG3' ' HE2' ' A' ' 485' ' ' LYS . 33.1 tt0 -65.27 131.07 45.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.725 -0.67 . . . . 65.43 110.259 -179.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.563 HD12 ' HB3' ' A' ' 486' ' ' TRP . 85.6 mt -85.54 118.24 24.93 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.945 -0.391 . . . . 71.22 109.945 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 5.1 t -67.18 145.85 54.82 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.571 -0.741 . . . . 75.1 111.161 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . 0.479 ' H ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -120.44 16.09 12.12 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.14 -0.689 . . . . 75.42 109.14 175.047 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -76.98 -60.97 2.14 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.231 -0.895 . . . . 64.43 109.578 176.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 497' ' ' GLU . 0.8 OUTLIER -105.31 106.56 17.11 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.286 0.565 . . . . 74.24 109.899 174.595 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.487 HG21 ' HE1' ' A' ' 503' ' ' PHE . 2.8 p -136.73 87.62 2.3 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.392 0.615 . . . . 73.03 111.505 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -105.8 -26.69 11.65 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.597 -0.729 . . . . 63.1 109.339 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . 0.429 ' HE3' ' CE2' ' A' ' 501' ' ' TYR . 42.2 pttt -94.51 -22.83 17.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.262 -0.881 . . . . 71.52 110.831 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.478 ' O ' ' HB ' ' A' ' 498' ' ' THR . 6.6 m-85 -118.88 133.67 55.68 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.703 -0.48 . . . . 54.12 109.703 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' ARG . . . . . 0.619 ' HB2' ' CG2' ' A' ' 513' ' ' ILE . 33.7 mmt180 -122.99 126.79 47.83 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.902 -0.407 . . . . 74.44 109.902 176.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . 0.487 ' HE1' HG21 ' A' ' 498' ' ' THR . 88.7 m-85 -94.98 113.26 24.95 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.063 -0.347 . . . . 74.25 110.063 178.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.647 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 4.7 mptp? -102.08 119.89 39.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.608 -0.269 . . . . 72.32 111.047 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -102.62 111.91 24.43 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.261 -0.644 . . . . 53.43 109.261 173.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 509' ' ' ARG . 33.1 t70 -136.28 74.6 1.51 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.299 0.571 . . . . 74.25 110.137 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 82.58 -131.71 10.58 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.804 -0.712 . . . . 51.3 112.055 -178.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.401 ' HB3' ' O ' ' A' ' 477' ' ' VAL . 20.3 mt-30 -79.23 -23.63 43.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.066 0.46 . . . . 52.4 110.397 -178.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 506' ' ' ASP . 18.4 ptt180 -89.48 143.32 26.91 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.501 -0.772 . . . . 73.11 110.805 -177.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 -130.26 118.96 22.14 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.826 -0.624 . . . . 61.02 109.492 -179.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . 0.647 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 13.5 m-70 -101.87 122.84 44.76 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.993 -0.283 . . . . 71.4 110.349 -176.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 67.8 tp -105.75 108.51 20.06 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.556 -0.535 . . . . 73.54 109.556 172.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.619 ' CG2' ' HB2' ' A' ' 502' ' ' ARG . 9.8 tp -99.47 124.72 52.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.323 0.582 . . . . 74.11 110.328 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 74.5 mt -104.29 111.7 34.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 N-CA-C 108.93 -0.767 . . . . 72.41 108.93 173.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -72.92 -44.04 61.68 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.132 0.491 . . . . 73.23 110.829 -176.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -131.24 108.85 9.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.815 -0.629 . . . . 75.5 109.885 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.428 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -90.52 131.37 36.3 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.191 -0.459 . . . . 73.22 110.768 -178.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . 0.527 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 10.1 mmt -95.69 167.25 11.4 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.225 -0.443 . . . . 74.01 110.502 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.485 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.7 mm? -62.39 -53.73 50.7 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.88 0.371 . . . . 74.43 111.593 -176.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -81.57 -12.15 58.88 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.114 0.483 . . . . 74.35 110.669 -177.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . 0.527 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 29.1 t70 -74.93 -16.41 60.65 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.713 -0.676 . . . . 74.0 111.057 -175.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.567 ' HB1' ' O ' ' A' ' 538' ' ' LEU . . . -61.42 -41.77 97.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.644 -0.253 . . . . 43.13 110.409 -178.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 40.0 -157.23 0.03 OUTLIER Glycine 0 CA--C 1.522 0.53 0 N-CA-C 116.0 1.16 . . . . 72.5 116.0 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 69.7 m-70 -118.49 107.24 13.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.57 -0.815 . . . . 63.51 109.056 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' A' ' 493' ' ' LEU . 29.0 m-85 -85.94 133.55 33.93 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.069 0.461 . . . . 64.33 111.283 -176.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -135.56 137.75 42.31 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.769 -0.65 . . . . 72.03 110.558 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.568 HD11 ' HB ' ' A' ' 484' ' ' VAL . 42.1 tp -102.87 110.09 21.89 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.054 -0.521 . . . . 60.34 110.172 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . 0.416 ' SG ' HD13 ' A' ' 487' ' ' LEU . 94.6 m -90.76 117.09 29.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.147 -0.478 . . . . 62.32 110.189 179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.634 HG23 HG12 ' A' ' 484' ' ' VAL . 0.2 OUTLIER -115.82 -169.86 1.67 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.88 -0.6 . . . . 43.23 110.275 -177.711 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . 0.55 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 17.3 m -55.57 8.96 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.12 1.368 . . . . 74.22 113.772 173.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . 0.513 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.76 26.88 2.03 Favored Glycine 0 N--CA 1.45 -0.405 0 CA-C-O 121.515 0.508 . . . . 42.21 111.942 -170.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -115.04 144.47 18.45 Favored Glycine 0 N--CA 1.445 -0.754 0 N-CA-C 109.608 -1.397 . . . . 61.14 109.608 165.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.3 tp60 -132.7 120.74 22.1 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 117.586 0.693 . . . . 72.44 111.405 -174.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -127.44 147.1 50.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.658 -0.701 . . . . 74.01 109.658 173.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.506 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.0 tm? -123.43 137.76 54.74 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.879 -0.415 . . . . 44.11 109.879 -176.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.542 ' HB2' ' CB ' ' A' ' 460' ' ' LEU . . . -132.51 141.05 48.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.439 -0.346 . . . . 71.41 110.324 177.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -121.47 117.21 26.28 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.233 0.539 . . . . 63.3 110.978 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.567 ' O ' ' HB1' ' A' ' 522' ' ' ALA . 46.9 tp -102.01 140.47 36.25 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.284 -0.871 . . . . 73.41 109.162 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.585 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 5.0 mp -125.28 108.62 20.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.536 -0.542 . . . . 41.51 109.536 177.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.453 HG23 ' HB2' ' A' ' 522' ' ' ALA . 66.7 t -107.13 129.3 61.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.921 0.391 . . . . 74.21 110.647 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.51 150.95 50.64 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.833 -0.622 . . . . 63.12 109.529 178.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . 0.512 ' HG2' HG21 ' A' ' 467' ' ' VAL . 34.3 mt-10 -73.93 108.75 6.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.059 0.457 . . . . 73.02 110.407 178.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . 0.405 ' HG3' ' HG2' ' A' ' 466' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 N-CA-C 108.889 -0.782 . . . . 72.45 108.889 179.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 N-CA-C 111.999 -0.44 . . . . 71.11 111.999 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 22.2 m -64.36 132.81 51.19 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 120.885 0.374 . . . . 72.35 110.331 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -88.36 74.77 8.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.33 0.586 . . . . 73.03 110.702 -178.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 55.8 ttp -96.56 104.63 18.59 Favored Pre-proline 0 C--N 1.321 -0.647 0 N-CA-C 108.691 -0.855 . . . . 73.2 108.691 173.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -69.56 131.42 21.49 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 121.678 1.585 . . . . 65.22 111.205 -177.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.455 ' H ' ' HB2' ' A' ' 530' ' ' SER . 94.7 t -76.2 107.69 7.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.761 0 N-CA-C 109.485 -0.561 . . . . 75.2 109.485 178.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 54.6 tp -98.43 133.42 42.84 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.67 -0.695 . . . . 70.52 110.142 -176.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 54.2 mt -74.04 102.84 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 109.242 -0.651 . . . . 74.43 109.242 178.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.25 -13.19 57.42 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.415 -0.812 . . . . 42.53 110.657 -173.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.478 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 18.8 tpp180 -137.95 112.04 8.82 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 116.001 -0.545 . . . . 63.23 109.764 175.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -57.19 166.2 4.57 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.786 2.324 . . . . 70.03 111.669 176.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.691 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 1.7 mm? -74.3 171.75 13.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.385 -0.371 . . . . 71.34 110.474 -175.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -66.67 148.25 52.16 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.868 -0.606 . . . . 73.41 111.805 -171.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -105.35 9.94 33.63 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 113.768 1.025 . . . . 73.22 113.768 -169.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.92 153.18 38.81 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 119.063 -1.055 . . . . 75.35 112.592 -165.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.575 ' H ' HD23 ' A' ' 464' ' ' LEU . 1.9 pt? -94.18 146.9 23.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.008 -1.451 . . . . 73.41 111.353 -173.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.617 HG23 HG22 ' A' ' 540' ' ' VAL . 29.7 m -128.34 177.2 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.201 -0.454 . . . . 73.1 111.682 -175.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -109.31 165.82 11.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 75.05 110.276 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . 0.435 HG12 ' HA ' ' A' ' 518' ' ' MET . 13.9 m -68.08 139.56 20.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 121.003 0.43 . . . . 62.55 111.263 177.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 78.61 4.03 87.31 Favored Glycine 0 CA--C 1.518 0.268 0 CA-C-N 115.899 -0.591 . . . . 62.35 113.452 175.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -108.21 143.85 36.46 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.848 -0.427 . . . . 52.23 109.848 178.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . 0.6 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 0.0 OUTLIER -66.42 140.4 58.05 Favored 'General case' 0 C--O 1.237 0.435 0 CA-C-O 121.18 0.514 . . . . 62.45 110.997 -179.134 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.475 HG22 HG21 ' A' ' 465' ' ' VAL . 4.6 t -114.52 133.37 60.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.712 -0.676 . . . . 61.04 109.654 177.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -112.37 119.47 38.37 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.054 0.454 . . . . 75.04 110.467 178.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.493 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 36.6 m-85 -109.46 130.58 55.49 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.524 -0.762 . . . . 63.5 110.635 174.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -109.65 140.55 43.35 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.016 -0.538 . . . . 72.0 110.149 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.639 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 21.9 p -149.47 125.46 10.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.788 0.328 . . . . 63.21 110.872 177.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.478 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 44.8 mt-10 -108.56 140.92 41.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.15 -0.477 . . . . 75.54 109.739 178.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.434 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 27.9 m -130.24 170.6 18.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.61 0.243 . . . . 75.53 110.658 176.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 12.5 p -70.6 -35.3 72.93 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.514 0.561 . . . . 51.22 112.514 -174.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . 0.572 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 39.6 tt0 -101.96 134.14 45.64 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.72 0.295 . . . . 72.2 110.93 -178.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . 0.607 ' HA ' ' HA ' ' A' ' 508' ' ' GLN . 14.0 pt-20 -79.23 132.26 36.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.954 0.407 . . . . 74.44 110.059 176.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . 0.556 ' HA2' ' HD2' ' A' ' 505' ' ' LYS . . . 75.93 12.01 84.28 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.783 -0.723 . . . . 23.35 112.437 -176.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.572 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -60.37 141.58 56.09 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.781 0.324 . . . . 74.31 111.477 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . 0.448 ' H ' ' NE2' ' A' ' 483' ' ' GLN . 0.0 OUTLIER -83.69 118.03 23.6 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.321 0.581 . . . . 72.23 110.558 -178.415 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 26.3 m -136.12 159.69 38.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.656 -0.702 . . . . 75.52 110.222 -178.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 66.0 pttt -136.0 152.94 51.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.806 0.336 . . . . 71.34 110.497 176.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 57.0 m95 -102.78 134.0 46.9 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.094 -0.503 . . . . 72.52 111.359 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . 0.557 HD13 ' SG ' ' A' ' 528' ' ' CYS . 10.7 mp -118.33 136.28 53.81 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.699 -0.682 . . . . 73.23 109.205 172.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.463 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 3.0 tmmm? -120.66 110.33 16.28 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.878 0.37 . . . . 72.22 110.077 -177.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.5 t70 58.04 35.66 25.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.182 -0.917 . . . . 74.32 110.591 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 92.79 -9.23 75.89 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.673 -0.694 . . . . 61.35 112.88 178.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 46.9 t -101.42 122.95 54.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 110.189 -0.3 . . . . 71.44 110.189 -179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . 0.542 ' HA ' ' HG ' ' A' ' 487' ' ' LEU . 36.0 tt0 -70.99 127.82 33.87 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.097 -0.501 . . . . 65.14 110.232 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.665 HD11 ' HE1' ' A' ' 525' ' ' TYR . 91.7 mt -77.53 119.82 21.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.269 -0.423 . . . . 74.5 110.24 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 15.0 t -71.64 144.51 49.39 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.184 0.516 . . . . 71.33 110.234 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . 0.496 ' N ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -113.98 10.3 17.55 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.052 -0.522 . . . . 73.23 109.983 -179.387 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 35.8 mm-40 -79.4 -36.2 39.49 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.112 -0.699 . . . . 54.42 109.112 175.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.77 133.79 47.2 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.809 -0.812 . . . . 74.33 108.809 172.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.519 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.3 OUTLIER -151.17 88.72 1.47 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.348 0.594 . . . . 62.25 111.164 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -101.92 -23.66 14.11 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.494 -0.775 . . . . 72.53 109.289 176.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 50.4 mtmt -92.61 -22.63 19.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.505 -0.77 . . . . 55.33 110.406 178.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.519 ' O ' ' HB ' ' A' ' 498' ' ' THR . 27.7 m-85 -128.97 161.05 30.81 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.402 -0.363 . . . . 74.03 110.355 -176.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' ARG . . . . . 0.429 ' HD2' ' HA ' ' A' ' 502' ' ' ARG . 2.1 tpt180 -152.94 123.84 7.41 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.171 -0.678 . . . . 72.42 109.171 173.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -95.03 112.84 24.5 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.191 -0.459 . . . . 64.2 110.39 -176.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.93 124.48 48.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.973 0.416 . . . . 75.3 110.635 178.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.556 ' HD2' ' HA2' ' A' ' 481' ' ' GLY . 1.6 tppp? -91.5 126.38 36.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.706 -0.679 . . . . 75.23 109.577 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -148.12 84.3 1.51 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.327 0.584 . . . . 74.44 110.573 -176.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.4 -127.22 29.01 Favored Glycine 0 N--CA 1.449 -0.463 0 CA-C-N 115.669 -0.696 . . . . 53.44 112.699 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.607 ' HA ' ' HA ' ' A' ' 480' ' ' GLU . 26.0 mt-30 -84.66 -3.65 58.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.562 0.22 . . . . 74.42 111.46 -178.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -118.09 153.88 33.02 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.493 0.663 . . . . 71.41 111.176 -177.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . 0.639 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 36.3 m-70 -124.88 126.21 45.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.416 -0.811 . . . . 74.02 109.17 -179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 64.8 m-70 -101.54 117.33 34.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.518 -0.549 . . . . 74.13 109.518 -177.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.493 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 55.4 tp -101.32 121.68 42.32 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.293 -0.412 . . . . 70.03 110.059 178.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 10.8 tp -106.39 130.3 58.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.729 -0.471 . . . . 73.33 109.729 176.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.6 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 54.6 mt -105.47 112.59 39.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 108.781 -0.822 . . . . 73.02 108.781 171.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -75.34 -48.49 22.82 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.956 -0.566 . . . . 64.42 110.646 -176.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -122.18 108.41 13.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.87 -0.605 . . . . 71.2 110.125 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -101.82 136.45 41.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.1 -0.5 . . . . 51.43 111.288 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . 0.435 ' HA ' HG12 ' A' ' 467' ' ' VAL . 9.3 mmt -126.47 175.97 7.5 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.951 -0.568 . . . . 75.44 110.711 175.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.501 ' H ' HD22 ' A' ' 519' ' ' LEU . 2.9 mm? -61.49 -55.66 28.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.38 -0.373 . . . . 75.32 111.586 -171.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -84.14 -10.15 58.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.821 0.343 . . . . 75.42 111.376 -177.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -80.15 -13.0 59.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.128 -0.487 . . . . 44.32 109.876 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.601 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -70.73 -41.64 71.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.195 -0.457 . . . . 63.31 111.021 179.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.54 -158.25 0.07 OUTLIER Glycine 0 CA--C 1.523 0.583 0 N-CA-C 114.975 0.75 . . . . 63.04 114.975 176.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -117.22 110.9 18.71 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.271 -0.64 . . . . 72.45 109.271 174.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . 0.665 ' HE1' HD11 ' A' ' 493' ' ' LEU . 30.1 m-85 -85.03 131.72 34.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.489 0.662 . . . . 54.42 111.756 -174.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.78 126.74 25.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.958 -1.019 . . . . 63.54 109.699 177.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 47.4 tp -87.99 115.29 25.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.135 -0.484 . . . . 75.13 109.971 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . 0.557 ' SG ' HD13 ' A' ' 487' ' ' LEU . 76.3 m -94.61 113.08 24.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.133 0.492 . . . . 72.54 109.864 179.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.441 ' C ' ' H ' ' A' ' 531' ' ' GLY . 54.6 p -116.85 -166.78 1.2 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.573 -0.74 . . . . 61.53 111.401 -174.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . 0.455 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 19.2 m -59.88 6.56 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.792 1.237 . . . . 71.45 113.234 174.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . 0.441 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 121.47 28.22 1.65 Allowed Glycine 0 C--O 1.228 -0.251 0 C-N-CA 120.992 -0.623 . . . . 74.14 113.677 -176.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -116.55 138.14 14.16 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 109.607 -1.397 . . . . 73.21 109.607 163.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.67 143.31 51.09 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 117.8 0.8 . . . . 73.53 112.302 -172.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -154.59 143.78 21.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.103 -0.953 . . . . 64.52 109.097 175.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.448 HD13 ' N ' ' A' ' 536' ' ' ALA . 3.2 tm? -127.02 135.73 51.24 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.852 -0.425 . . . . 53.03 109.852 -176.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.691 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -135.43 159.99 39.86 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.267 -0.424 . . . . 74.34 110.561 177.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -125.56 120.42 30.8 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.044 -0.526 . . . . 75.41 110.218 -178.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' A' ' 522' ' ' ALA . 50.3 tp -99.67 126.99 45.78 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.264 -0.643 . . . . 71.41 109.264 178.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.423 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 66.4 mt -113.79 116.75 53.5 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-N 116.372 -0.376 . . . . 71.33 110.323 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.617 HG22 HG23 ' A' ' 465' ' ' VAL . 95.4 t -109.66 134.34 52.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.496 -0.557 . . . . 74.41 109.496 175.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.05 164.37 18.71 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.022 -0.733 . . . . 62.11 109.022 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -86.9 105.23 16.93 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.571 -0.529 . . . . 64.4 109.571 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 53.6 pttt . . . . . 0 C--O 1.247 0.929 0 CA-C-N 115.679 -0.691 . . . . 74.25 109.471 178.241 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.527 -0.629 . . . . 50.04 111.527 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 21.5 t -145.21 175.06 10.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.791 0.296 . . . . 53.3 110.427 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -133.06 135.56 45.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.33 -0.619 . . . . 75.33 109.33 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 24.0 ptm -82.58 136.75 45.1 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-O 120.749 0.309 . . . . 70.12 111.499 -175.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -69.76 135.34 30.22 Favored 'Trans proline' 0 N--CA 1.458 -0.598 0 C-N-CA 122.133 1.889 . . . . 62.44 110.644 171.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.575 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 58.8 t -65.95 114.24 3.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.918 0.389 . . . . 73.33 110.883 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 44.5 tp -89.2 157.77 18.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.686 -0.688 . . . . 50.01 110.545 -177.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.579 HD13 HD23 ' A' ' 527' ' ' LEU . 37.5 mt -101.96 112.61 35.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.052 -0.522 . . . . 75.13 110.087 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 20.9 p -86.49 -26.91 24.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.29 -0.414 . . . . 63.54 111.556 -176.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.503 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 7.1 tpt180 -107.1 114.35 61.42 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 116.277 -0.42 . . . . 74.42 110.091 177.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 458' ' ' ARG . 37.4 Cg_endo -65.95 158.12 55.78 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 122.589 2.193 . . . . 62.11 111.446 176.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.625 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 8.8 mp -73.61 160.45 31.6 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.115 -0.493 . . . . 43.54 110.574 -178.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . 0.479 ' HB2' ' CD1' ' A' ' 473' ' ' PHE . 0.2 OUTLIER -65.0 146.99 54.3 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.512 0.673 . . . . 72.44 112.216 -173.599 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -104.35 7.36 35.66 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 114.933 -1.031 . . . . 71.54 112.515 -171.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . 0.478 HE22 ' HB3' ' A' ' 461' ' ' GLU . 0.2 OUTLIER -124.49 154.13 40.99 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 119.872 -0.731 . . . . 72.24 111.805 -167.745 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.695 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.3 pt? -118.44 145.46 45.22 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.825 -1.079 . . . . 70.01 111.414 -168.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.443 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 29.3 m -119.77 177.15 3.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.036 -0.529 . . . . 53.13 111.485 -176.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -107.83 172.03 7.06 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.919 -0.582 . . . . 74.22 110.383 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 40.3 t -62.45 130.31 26.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.455 -0.339 . . . . 72.43 110.995 -178.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 90.54 7.37 67.02 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.776 -0.726 . . . . 62.24 112.626 178.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -117.85 138.73 51.91 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.884 0.373 . . . . 72.24 110.525 178.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . 0.554 ' O ' ' HD3' ' A' ' 470' ' ' ARG . 0.0 OUTLIER -82.02 153.6 26.09 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.697 -0.683 . . . . 65.21 111.451 -179.124 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.433 HG12 ' HB ' ' A' ' 514' ' ' ILE . 7.4 p -145.42 131.08 13.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.991 -0.549 . . . . 73.02 110.58 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.437 ' CG ' HD13 ' A' ' 513' ' ' ILE . 41.0 mt-10 -99.37 128.21 45.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.433 -0.349 . . . . 74.3 110.964 177.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.479 ' CD1' ' HB2' ' A' ' 461' ' ' GLU . 92.9 m-85 -107.6 112.16 24.75 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.625 -0.88 . . . . 74.04 108.625 167.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -96.45 140.24 31.38 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.232 0.539 . . . . 75.1 110.623 179.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.591 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 8.7 p -139.25 137.81 36.24 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.451 -0.795 . . . . 75.31 109.779 176.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.503 ' H ' ' HB3' ' A' ' 458' ' ' ARG . 45.3 mt-10 -119.46 138.98 52.78 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.529 -0.545 . . . . 70.5 109.529 179.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.575 ' HB ' ' CG1' ' A' ' 454' ' ' VAL . 9.6 m -122.58 152.14 26.83 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 116.106 -0.497 . . . . 74.41 110.917 -177.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 6.5 m -63.19 -19.63 64.68 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.818 -0.628 . . . . 61.13 112.094 -178.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . 0.499 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 35.8 tt0 -108.75 135.25 50.28 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.819 0.342 . . . . 75.32 110.437 -176.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . 0.667 ' HA ' ' HG2' ' A' ' 508' ' ' GLN . 13.7 pt-20 -75.49 135.96 40.64 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.177 -0.465 . . . . 71.34 110.577 -178.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . 0.445 ' HA2' ' HD3' ' A' ' 505' ' ' LYS . . . 67.05 8.74 51.26 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.145 -0.55 . . . . 41.11 113.075 178.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.527 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -57.67 139.59 53.36 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 120.849 0.356 . . . . 74.23 111.221 -177.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -79.43 128.29 33.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.648 -0.705 . . . . 65.13 110.143 -177.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.619 ' HB ' HD11 ' A' ' 527' ' ' LEU . 32.7 m -121.88 150.85 25.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.253 -0.431 . . . . 73.15 110.258 178.036 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -134.83 134.98 41.39 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.766 -0.457 . . . . 63.23 109.766 179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . 0.431 ' CD2' HD22 ' A' ' 512' ' ' LEU . 72.0 m95 -103.34 131.46 50.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.919 0.39 . . . . 75.52 111.165 -175.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . 0.567 ' HG ' ' HA ' ' A' ' 492' ' ' GLU . 10.7 mp -120.02 158.02 27.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.903 -0.589 . . . . 72.14 109.47 174.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.468 ' HD3' ' HA3' ' A' ' 523' ' ' GLY . 1.7 tmmm? -140.81 109.27 5.88 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.116 -0.327 . . . . 75.45 110.116 -178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 57.63 35.4 25.64 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.898 -0.592 . . . . 74.42 111.061 -177.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 86.94 -11.78 63.76 Favored Glycine 0 N--CA 1.446 -0.675 0 CA-C-N 115.778 -0.646 . . . . 72.24 112.741 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 60.7 t -79.03 122.95 35.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 N-CA-C 109.805 -0.443 . . . . 44.32 109.805 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . 0.567 ' HA ' ' HG ' ' A' ' 487' ' ' LEU . 33.4 tt0 -78.71 111.31 14.67 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.902 -0.59 . . . . 72.25 110.2 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 86.9 mt -68.37 134.94 51.03 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.016 0.436 . . . . 61.03 110.177 178.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 14.3 t -91.58 160.16 15.54 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.978 -0.555 . . . . 71.22 110.024 -177.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 -125.82 11.94 7.84 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.813 -0.63 . . . . 74.31 110.559 -177.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -75.55 -35.06 60.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.613 -0.721 . . . . 53.54 109.801 176.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -136.23 139.6 42.86 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.621 -0.881 . . . . 73.31 108.621 170.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.562 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 0.6 OUTLIER -150.37 88.01 1.48 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.434 0.635 . . . . 63.51 111.166 179.094 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -104.94 -17.97 14.35 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.591 -0.732 . . . . 52.24 109.912 174.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 49.2 mtmt -92.72 -47.05 7.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.733 -0.667 . . . . 65.41 109.841 174.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.562 ' O ' ' HB ' ' A' ' 498' ' ' THR . 45.6 m-85 -103.17 161.21 13.99 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.928 -0.578 . . . . 70.13 109.926 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' ARG . . . . . 0.472 ' HB2' HG23 ' A' ' 513' ' ' ILE . 49.1 mtp180 -144.34 135.49 25.35 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.175 -0.676 . . . . 61.4 109.175 174.09 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -107.4 113.14 26.31 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.475 -0.565 . . . . 73.23 109.475 -175.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -120.4 145.83 46.8 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 115.858 -0.61 . . . . 62.21 110.968 -172.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.445 ' HD3' ' HA2' ' A' ' 481' ' ' GLY . 3.7 ttmp? -128.82 118.42 22.73 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.847 -0.615 . . . . 73.14 109.846 -178.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . 0.54 ' HB3' ' HG3' ' A' ' 509' ' ' ARG . 15.3 t70 -127.62 82.73 2.1 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.421 -0.585 . . . . 73.31 109.421 177.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.37 -101.18 0.59 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.059 -0.591 . . . . 75.42 112.041 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.667 ' HG2' ' HA ' ' A' ' 480' ' ' GLU . 20.9 mt-30 -109.19 -8.63 15.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.824 0.345 . . . . 73.42 110.822 -179.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.54 ' HG3' ' HB3' ' A' ' 506' ' ' ASP . 36.7 ptt180 -104.94 133.25 50.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.363 0.601 . . . . 60.1 110.761 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . 0.591 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 83.2 m-70 -113.65 144.62 42.61 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.818 -0.628 . . . . 73.42 109.792 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -119.8 118.32 30.51 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 110.134 -0.321 . . . . 71.01 110.134 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.431 HD22 ' CD2' ' A' ' 486' ' ' TRP . 53.2 tp -96.55 103.5 15.42 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 108.597 -0.89 . . . . 64.2 108.597 170.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.554 HD11 ' HB2' ' A' ' 470' ' ' ARG . 5.4 tp -101.34 112.63 34.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-O 121.482 0.658 . . . . 61.52 110.505 -178.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.519 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 60.9 mt -86.46 115.53 27.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 108.482 -0.933 . . . . 64.2 108.482 174.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -68.82 -51.52 39.84 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.961 0.41 . . . . 72.34 110.537 -177.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -133.76 109.41 9.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.802 -0.636 . . . . 74.53 109.841 -179.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -88.0 138.43 31.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.974 0.416 . . . . 71.41 111.017 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . 0.648 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 25.4 mmt -109.34 170.12 8.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.923 -0.58 . . . . 62.12 110.371 179.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.556 HD11 ' HG3' ' A' ' 542' ' ' GLU . 3.0 mm? -64.24 -53.52 47.78 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.241 -0.436 . . . . 72.13 111.229 -173.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -81.38 -5.06 57.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.262 -0.426 . . . . 75.43 110.907 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . 0.648 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 7.9 t70 -86.8 -14.56 41.87 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.088 -0.505 . . . . 74.02 110.57 -176.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.673 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -69.16 -43.67 73.81 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.817 -0.353 . . . . 75.51 111.344 -175.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . 0.468 ' HA3' ' HD3' ' A' ' 488' ' ' LYS . . . 40.27 -158.53 0.02 OUTLIER Glycine 0 CA--C 1.524 0.655 0 N-CA-C 115.9 1.12 . . . . 74.41 115.9 172.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -111.14 111.55 22.71 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.78 -0.71 . . . . 73.13 109.086 170.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . 0.454 ' HH ' ' HE1' ' A' ' 501' ' ' TYR . 40.4 m-85 -86.19 131.53 34.22 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.028 0.442 . . . . 71.24 111.103 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -132.27 126.09 32.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.589 -0.732 . . . . 72.21 110.073 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.619 HD11 ' HB ' ' A' ' 484' ' ' VAL . 45.5 tp -86.9 119.92 27.63 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.196 -0.456 . . . . 73.23 110.12 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . 0.504 ' SG ' HD13 ' A' ' 487' ' ' LEU . 86.4 m -100.88 112.97 25.51 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.457 -0.571 . . . . 61.32 109.457 177.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.533 HG23 HG12 ' A' ' 484' ' ' VAL . 0.2 OUTLIER -115.89 -168.39 1.41 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.642 -0.708 . . . . 40.0 110.389 -175.946 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . 0.447 ' H ' HG22 ' A' ' 529' ' ' THR . 7.5 m -55.21 7.25 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.935 1.294 . . . . 22.42 113.694 173.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . 0.524 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.9 26.83 2.01 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-O 121.638 0.577 . . . . 72.43 111.831 -168.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -114.91 150.23 18.74 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 109.684 -1.366 . . . . 52.41 109.684 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . 0.415 ' NE2' ' H ' ' A' ' 534' ' ' ALA . 0.0 OUTLIER -134.77 142.75 46.8 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 117.55 0.675 . . . . 72.03 110.762 -176.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . 0.415 ' H ' ' NE2' ' A' ' 533' ' ' GLN . . . -153.06 123.48 7.16 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.656 -0.702 . . . . 72.44 109.778 177.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.438 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.7 tm? -103.99 132.82 49.87 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.173 -0.467 . . . . 74.51 110.114 -177.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.625 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -121.02 149.25 42.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.37 -0.377 . . . . 53.11 110.42 177.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -116.31 120.58 39.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.173 -0.467 . . . . 62.12 110.084 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.49 HD23 ' HA ' ' A' ' 522' ' ' ALA . 48.3 tp -127.51 134.73 49.78 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.284 -0.416 . . . . 71.42 110.462 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.579 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.8 mp -130.8 125.23 58.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 109.128 -0.693 . . . . 64.13 109.128 174.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.673 HG23 ' HB2' ' A' ' 522' ' ' ALA . 70.1 t -104.41 143.71 15.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 110.02 -0.363 . . . . 63.32 110.02 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . 0.408 ' N ' HE21 ' A' ' 541' ' ' GLN . 0.0 OUTLIER -126.29 150.26 48.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.756 0.312 . . . . 63.3 110.628 -176.642 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . 0.556 ' HG3' HD11 ' A' ' 519' ' ' LEU . 45.2 mt-10 -89.5 123.33 33.51 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.698 -0.683 . . . . 55.25 110.185 175.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . 0.509 ' HD2' ' C ' ' A' ' 543' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.89 0 CA-C-N 115.6 -0.727 . . . . 72.44 109.809 177.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.686 0 N-CA-C 111.868 -0.493 . . . . 61.21 111.868 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 43.2 p -106.12 -172.55 2.11 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.103 -0.332 . . . . 62.43 110.103 178.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 21.3 m80 -77.34 63.8 2.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.394 0.616 . . . . 72.23 110.543 175.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 23.4 ptm -115.22 132.57 22.99 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 115.449 -0.796 . . . . 51.1 110.107 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.75 135.62 57.3 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.235 1.957 . . . . 42.22 111.662 175.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.495 ' H ' ' HB2' ' A' ' 530' ' ' SER . 87.2 t -64.51 108.79 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.215 0.531 . . . . 64.42 110.408 178.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 50.1 tp -80.63 139.29 36.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.595 -0.73 . . . . 73.54 110.17 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 55.1 mt -91.14 114.93 29.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.867 -0.606 . . . . 72.32 109.789 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 24.7 p -86.2 -17.96 33.44 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.264 0.554 . . . . 75.33 111.498 -175.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.42 ' HB3' ' HB2' ' A' ' 476' ' ' GLU . 10.9 tpt85 -136.95 104.64 8.87 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.955 -0.566 . . . . 73.45 110.359 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . 0.41 ' HA ' ' HB1' ' A' ' 534' ' ' ALA . 26.2 Cg_exo -62.71 167.38 11.87 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.891 2.394 . . . . 54.32 111.285 174.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.689 ' HB2' ' CB ' ' A' ' 536' ' ' ALA . 0.8 OUTLIER -69.81 167.84 16.37 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.606 -0.516 . . . . 63.53 109.606 -177.79 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . 0.531 ' HA ' ' OE1' ' A' ' 461' ' ' GLU . 2.4 tp10 -73.15 161.59 30.42 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.264 0.554 . . . . 74.34 111.64 -172.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -104.25 8.76 36.16 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 113.989 1.107 . . . . 74.52 113.989 -166.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.11 154.23 37.64 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.381 0.991 . . . . 54.23 112.471 -165.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.686 ' H ' HD23 ' A' ' 464' ' ' LEU . 2.5 pt? -106.56 146.83 30.17 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.051 -1.431 . . . . 74.3 111.576 -170.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.466 HG22 HD11 ' A' ' 538' ' ' LEU . 30.1 m -123.36 177.41 4.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-O 121.006 0.431 . . . . 65.32 111.457 -179.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -97.5 166.75 11.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.008 -0.542 . . . . 74.23 110.986 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . 0.409 HG22 HG12 ' A' ' 540' ' ' VAL . 38.3 t -62.08 127.35 21.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.716 -0.675 . . . . 33.25 111.604 -176.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 88.16 -13.35 61.82 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.003 -0.617 . . . . 72.04 113.144 174.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -87.58 144.58 26.62 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.95 -0.389 . . . . 61.01 109.95 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . 0.627 ' HA ' ' O ' ' A' ' 514' ' ' ILE . 2.3 ppt_? -76.65 145.56 38.74 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.276 0.56 . . . . 65.22 111.234 -177.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.445 HG12 ' HB ' ' A' ' 514' ' ' ILE . 7.2 p -131.9 142.26 43.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.674 -0.694 . . . . 72.43 109.978 178.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.562 ' HG2' HD13 ' A' ' 513' ' ' ILE . 34.1 mt-10 -112.19 125.3 53.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 75.54 110.546 -176.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.525 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 59.6 m-85 -112.88 123.2 49.77 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.287 -0.415 . . . . 65.11 111.34 178.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -95.02 138.33 32.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.736 -0.666 . . . . 63.42 110.543 177.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.644 ' SG ' ' HB2' ' A' ' 510' ' ' HIS . 6.0 p -148.81 133.3 17.64 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.25 -0.432 . . . . 53.4 110.387 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.48 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 43.9 mt-10 -131.78 139.81 49.02 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.36 -0.237 . . . . 64.41 110.36 -178.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . . . . . . . . . 30.1 m -123.41 161.15 25.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.343 -0.39 . . . . 72.12 110.488 177.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 34.3 t -80.9 8.47 8.23 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.271 -0.422 . . . . 53.52 112.114 -175.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . 0.546 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 4.5 tp10 -128.85 141.27 51.35 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.029 -0.359 . . . . 70.4 110.029 -179.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . 0.51 ' HA ' ' HG2' ' A' ' 508' ' ' GLN . 1.0 OUTLIER -88.84 136.92 32.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.746 0.308 . . . . 74.41 110.426 -178.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 60.55 31.75 75.79 Favored Glycine 0 C--N 1.33 0.217 0 C-N-CA 120.706 -0.759 . . . . 71.13 111.783 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.546 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -74.46 146.27 42.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.951 0.405 . . . . 63.25 111.303 -175.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . 0.527 ' CD ' ' H ' ' A' ' 483' ' ' GLN . 0.0 OUTLIER -78.2 111.33 14.02 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.764 -0.653 . . . . 63.14 110.326 179.318 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.68 HG12 HG22 ' A' ' 529' ' ' THR . 17.3 m -131.86 151.21 34.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.666 -0.697 . . . . 71.4 110.245 -177.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -135.06 155.13 51.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.902 0.382 . . . . 75.04 110.196 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . 0.584 ' HB3' HD12 ' A' ' 493' ' ' LEU . 52.2 m95 -105.57 127.24 52.92 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.132 -0.486 . . . . 63.54 110.908 -179.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . 0.554 HD12 ' SG ' ' A' ' 528' ' ' CYS . 65.1 mt -123.96 136.59 54.41 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.847 -0.615 . . . . 73.01 109.415 175.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.501 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 3.3 tmmm? -120.65 106.47 11.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.303 -0.408 . . . . 71.23 110.215 -177.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . 0.54 ' HB2' ' H ' ' A' ' 524' ' ' HIS . 13.7 t70 57.14 35.55 26.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.541 -0.754 . . . . 72.05 110.86 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 88.43 -3.72 85.28 Favored Glycine 0 N--CA 1.452 -0.262 0 CA-C-N 115.794 -0.639 . . . . 62.24 112.513 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 89.5 t -94.69 128.2 46.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.722 0.296 . . . . 71.11 110.818 -179.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . 0.524 ' HA ' ' CD2' ' A' ' 487' ' ' LEU . 4.7 tp10 -70.01 126.96 31.21 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.847 -0.615 . . . . 73.51 110.432 178.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.584 HD12 ' HB3' ' A' ' 486' ' ' TRP . 75.8 mt -87.55 98.01 11.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.119 0.485 . . . . 60.34 109.753 175.447 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . 0.504 ' OG1' ' HG2' ' A' ' 496' ' ' GLU . 6.2 t -64.27 123.33 18.84 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.599 -0.728 . . . . 72.04 111.223 -176.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . 0.636 ' H ' ' NE ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -100.61 13.07 35.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.042 -0.526 . . . . 62.34 110.768 -179.264 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . 0.504 ' HG2' ' OG1' ' A' ' 494' ' ' THR . 10.1 mm-40 -69.22 -36.66 77.48 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.325 -0.62 . . . . 74.32 109.325 178.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -151.53 108.22 3.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.143 -0.935 . . . . 71.51 109.364 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.6 ' HB ' ' O ' ' A' ' 501' ' ' TYR . 21.3 p -114.42 97.8 6.53 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.154 -0.475 . . . . 73.45 111.547 -176.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -91.03 -28.95 17.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.9 -0.591 . . . . 74.12 110.192 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -88.76 -46.97 8.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.941 -0.572 . . . . 75.45 110.312 179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.6 ' O ' ' HB ' ' A' ' 498' ' ' THR . 26.2 m-85 -99.32 154.96 17.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.624 -0.716 . . . . 65.04 110.093 -176.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 501' ' ' TYR . 21.5 mtp85 -148.09 123.17 10.12 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.549 -0.537 . . . . 75.53 109.549 171.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . 0.464 ' HE2' HG21 ' A' ' 498' ' ' THR . 72.6 m-85 -96.06 118.37 32.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.02 -0.537 . . . . 72.32 111.465 -172.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 4.6 mptp? -105.85 146.0 30.49 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.239 -0.437 . . . . 62.21 110.054 175.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.433 ' HD3' ' CE1' ' A' ' 510' ' ' HIS . 26.5 ttpt -129.37 128.06 42.28 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.85 0.357 . . . . 71.55 111.149 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -119.05 79.03 1.34 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.657 -0.701 . . . . 75.13 109.512 173.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.49 -90.78 0.24 Allowed Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.838 -0.619 . . . . 53.13 112.807 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.51 ' HG2' ' HA ' ' A' ' 480' ' ' GLU . 22.7 mt-30 -99.14 -26.06 14.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.804 0.335 . . . . 61.1 111.019 -177.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.48 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 17.1 ptt180 -103.55 153.74 20.24 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.21 0.529 . . . . 72.03 111.485 -173.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . 0.644 ' HB2' ' SG ' ' A' ' 475' ' ' CYS . 64.3 m-70 -124.64 156.54 37.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.045 -0.525 . . . . 74.11 110.76 -179.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 42.0 m-70 -125.99 119.3 27.34 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.08 -0.711 . . . . 75.14 109.08 176.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.525 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 64.4 tp -98.3 105.68 17.86 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.447 -0.575 . . . . 75.24 109.447 174.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.562 HD13 ' HG2' ' A' ' 472' ' ' GLU . 8.5 tp -97.54 112.81 30.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.792 0 CA-C-O 121.502 0.668 . . . . 44.42 109.571 176.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.627 ' O ' ' HA ' ' A' ' 470' ' ' ARG . 45.1 mt -96.66 112.08 28.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.611 -0.885 . . . . 61.03 108.611 175.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . 0.442 HD21 ' HD3' ' A' ' 502' ' ' ARG . 41.0 m-80 -68.81 -45.01 72.32 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 123.445 0.466 . . . . 74.03 111.353 -173.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -134.32 109.59 8.92 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.198 -0.456 . . . . 42.43 110.185 178.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.542 ' HB1' HG21 ' A' ' 540' ' ' VAL . . . -88.27 123.07 32.51 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.097 -0.501 . . . . 52.45 110.344 178.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . 0.724 ' HB2' ' HB2' ' A' ' 521' ' ' ASP . 30.2 mmt -90.05 173.36 8.24 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.256 -0.429 . . . . 75.12 110.103 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.32 -54.03 50.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.949 0.404 . . . . 75.1 110.853 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -82.89 -4.48 58.19 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.752 -0.658 . . . . 53.25 111.103 -177.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . 0.724 ' HB2' ' HB2' ' A' ' 518' ' ' MET . 6.8 t70 -80.41 -19.78 45.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 74.25 110.305 -176.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.527 ' HA ' HD23 ' A' ' 538' ' ' LEU . . . -62.66 -41.93 99.34 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.147 -0.479 . . . . 64.2 111.268 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.19 -157.32 0.07 OUTLIER Glycine 0 C--N 1.335 0.513 0 O-C-N 123.924 0.765 . . . . 65.2 114.811 173.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . 0.54 ' H ' ' HB2' ' A' ' 489' ' ' ASP . 60.5 m80 -120.66 108.65 14.27 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.734 -0.839 . . . . 74.25 108.734 171.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . 0.501 ' CZ ' ' HG3' ' A' ' 488' ' ' LYS . 26.3 m-85 -85.46 132.04 34.28 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.472 0.654 . . . . 74.2 111.857 -173.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -141.29 131.86 25.46 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.113 -0.949 . . . . 44.02 109.818 178.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.49 HD22 ' HB2' ' A' ' 475' ' ' CYS . 61.2 tp -86.67 116.3 24.69 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.245 -0.65 . . . . 71.44 109.245 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . 0.554 ' SG ' HD12 ' A' ' 487' ' ' LEU . 64.6 m -99.73 116.31 31.52 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.424 0.63 . . . . 63.22 110.597 -176.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.68 HG22 HG12 ' A' ' 484' ' ' VAL . 68.0 p -115.64 -165.67 1.06 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.95 -1.023 . . . . 71.43 110.229 -177.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . 0.495 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 2.7 m -52.68 4.25 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.645 1.178 . . . . 70.04 113.274 172.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . 0.522 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.85 27.59 1.87 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.392 -0.432 . . . . 72.11 113.233 -175.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -107.95 136.22 13.32 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 109.797 -1.321 . . . . 54.22 109.797 164.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 26.1 tp60 -113.03 121.06 43.48 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 117.201 0.5 . . . . 72.43 112.224 -171.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . 0.41 ' HB1' ' HA ' ' A' ' 459' ' ' PRO . . . -121.26 140.21 52.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.933 -0.576 . . . . 74.01 109.474 171.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.492 HD13 ' N ' ' A' ' 536' ' ' ALA . 2.8 tm? -128.36 138.94 52.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.767 0.318 . . . . 72.44 110.48 -175.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.689 ' CB ' ' HB2' ' A' ' 460' ' ' LEU . . . -146.94 159.92 42.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 74.53 110.112 176.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -127.04 116.75 21.21 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.057 0.456 . . . . 73.12 111.057 -176.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.527 HD23 ' HA ' ' A' ' 522' ' ' ALA . 52.6 tp -101.22 133.08 46.34 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.038 -0.727 . . . . 74.42 109.038 175.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.68 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 35.5 mt -125.49 116.7 47.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 109.762 -0.459 . . . . 74.22 109.762 178.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.542 HG21 ' HB1' ' A' ' 517' ' ' ALA . 97.8 t -112.81 120.16 62.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 120.771 0.319 . . . . 54.54 110.513 -178.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.58 162.21 30.86 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.943 -0.571 . . . . 55.52 109.798 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -85.33 109.12 18.16 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.44 -0.578 . . . . 61.31 109.44 173.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . 0.838 ' HE2' ' HA ' ' A' ' 543' ' ' LYS . 10.7 mmpt? . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.426 -0.797 . . . . 71.31 109.701 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.726 0 N-CA-C 111.901 -0.48 . . . . 53.14 111.901 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 20.7 t -87.14 124.49 33.32 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.954 0.407 . . . . 72.21 110.225 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 41.3 m-70 -77.17 125.15 28.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.822 -0.626 . . . . 75.44 110.319 177.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . 0.468 ' O ' ' HG3' ' A' ' 452' ' ' MET . 18.9 ptm -109.27 113.85 58.28 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 115.943 -0.571 . . . . 71.13 109.666 176.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . 0.436 ' HD2' ' HA ' ' A' ' 452' ' ' MET . 29.5 Cg_endo -63.96 151.31 85.79 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.307 2.005 . . . . 74.12 111.287 177.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.435 ' H ' ' HB2' ' A' ' 530' ' ' SER . 99.2 t -64.93 107.67 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-O 121.199 0.523 . . . . 54.33 110.063 176.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 47.3 tp -93.63 152.54 18.93 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.512 -0.767 . . . . 72.41 109.562 -177.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 56.6 mt -105.71 112.9 41.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 116.205 -0.452 . . . . 74.42 110.234 -177.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 43.8 p -86.43 -33.91 20.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.181 0.515 . . . . 70.23 110.416 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.485 ' HB3' ' H ' ' A' ' 476' ' ' GLU . 14.3 tpt180 -114.77 103.91 54.54 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.541 -0.754 . . . . 75.54 109.26 174.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.2 167.57 19.86 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.968 2.445 . . . . 65.44 112.272 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.878 ' HB3' ' HB2' ' A' ' 536' ' ' ALA . 79.6 mt -66.11 155.24 37.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.032 -0.531 . . . . 74.1 110.078 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -88.35 162.68 16.42 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 113.302 0.853 . . . . 73.31 113.302 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -104.53 6.33 34.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.245 -1.343 . . . . 72.54 113.93 -161.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -123.86 149.31 45.94 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 118.923 -1.111 . . . . 62.42 112.753 -162.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.612 ' HB2' ' O ' ' A' ' 539' ' ' ILE . 0.6 OUTLIER -114.48 144.9 42.6 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 113.97 -1.468 . . . . 71.4 111.391 -170.523 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.459 ' O ' ' HA ' ' A' ' 540' ' ' VAL . 28.2 m -117.92 177.93 2.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.115 -0.493 . . . . 63.22 111.303 -177.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -103.14 168.07 9.42 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.012 -0.54 . . . . 71.33 110.382 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 45.0 t -62.21 130.33 26.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.472 -0.331 . . . . 72.24 110.829 179.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 92.46 -11.22 72.61 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.877 -0.678 . . . . 45.21 112.616 178.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -101.09 144.17 30.32 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.431 -0.581 . . . . 73.42 109.431 178.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . 0.494 ' HD2' ' C ' ' A' ' 470' ' ' ARG . 0.0 OUTLIER -86.01 150.61 24.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.965 0.412 . . . . 64.13 110.72 -176.13 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.413 HG12 ' HB ' ' A' ' 514' ' ' ILE . 8.0 p -128.94 137.59 56.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.445 -0.576 . . . . 55.33 109.445 176.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.852 ' HG2' HG13 ' A' ' 513' ' ' ILE . 42.6 mt-10 -116.61 124.28 49.41 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.489 -0.323 . . . . 73.25 110.159 -176.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.456 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 76.9 m-85 -107.97 113.27 26.33 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.116 -0.493 . . . . 65.21 110.286 176.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -95.61 132.36 40.84 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.657 -0.701 . . . . 74.35 110.295 177.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 19.4 t -148.26 121.02 8.66 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.095 0.474 . . . . 53.43 110.507 179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.902 ' HG2' ' HB3' ' A' ' 509' ' ' ARG . 46.5 mt-10 -112.63 138.72 49.01 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.799 -0.637 . . . . 73.32 110.058 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.508 HG21 ' HB3' ' A' ' 482' ' ' ALA . 21.6 m -121.93 178.44 2.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.383 -0.371 . . . . 65.41 110.781 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 25.0 p -78.22 -21.61 49.73 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.598 0.592 . . . . 50.1 112.598 -174.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . 0.674 ' HB3' ' HB2' ' A' ' 482' ' ' ALA . 35.9 tt0 -119.02 138.91 52.5 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.997 0.427 . . . . 73.21 110.991 -175.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . 0.426 ' H ' ' CD ' ' A' ' 480' ' ' GLU . 1.4 pm0 -74.41 126.96 31.85 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.955 -0.566 . . . . 43.4 110.368 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 64.35 26.84 70.93 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.616 -0.802 . . . . 52.33 111.953 -174.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.674 ' HB2' ' HB3' ' A' ' 479' ' ' GLU . . . -57.94 156.76 8.65 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.012 0.745 . . . . 62.33 113.012 -176.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -71.86 105.48 3.82 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 114.886 -1.052 . . . . 64.24 109.553 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.54 ' HB ' HD11 ' A' ' 527' ' ' LEU . 29.3 m -128.06 150.7 34.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 120.908 0.385 . . . . 73.1 110.412 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 49.4 tttp -130.29 126.8 38.13 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.206 -0.664 . . . . 63.14 109.206 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . 0.412 ' HB3' HD12 ' A' ' 493' ' ' LEU . 86.1 m95 -100.92 116.81 33.66 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.739 0.304 . . . . 73.44 110.885 -175.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . 0.415 HD13 ' SG ' ' A' ' 528' ' ' CYS . 7.7 mp -118.23 140.8 49.26 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.035 -0.529 . . . . 61.23 110.393 177.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.537 ' HG3' ' CZ ' ' A' ' 525' ' ' TYR . 4.2 tmmm? -127.22 107.45 10.02 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.142 -0.688 . . . . 50.25 109.142 176.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 4.7 t70 58.56 35.55 24.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.577 0.703 . . . . 73.12 110.353 -178.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 92.99 -15.58 62.5 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.824 -0.703 . . . . 70.54 113.281 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 55.9 t -97.85 123.99 50.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.81 0.305 . . . . 72.43 110.561 -178.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -70.44 142.6 51.98 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.932 0.396 . . . . 74.04 110.75 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.708 HD11 ' HE2' ' A' ' 525' ' ' TYR . 59.7 mt -84.71 118.39 24.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.901 -0.59 . . . . 75.41 110.197 178.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 10.6 t -70.46 143.14 51.85 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.06 0.457 . . . . 72.21 110.414 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.93 7.64 11.52 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.177 -0.465 . . . . 74.44 110.596 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -62.18 -50.38 72.06 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.517 0.675 . . . . 75.02 109.579 177.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -152.65 118.16 5.3 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.81 -1.086 . . . . 75.52 108.82 174.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.61 121.65 16.76 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.85 0.357 . . . . 73.44 110.597 -176.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -107.49 -22.9 12.37 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.272 -0.422 . . . . 64.34 111.51 -178.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . 0.411 ' HE3' ' CE2' ' A' ' 501' ' ' TYR . 52.3 mtmt -73.97 -46.74 42.01 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.422 -0.585 . . . . 64.23 109.422 -179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.728 ' HB3' HG12 ' A' ' 514' ' ' ILE . 0.6 OUTLIER -136.09 144.98 45.45 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.282 -0.872 . . . . 73.51 110.298 179.032 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.88 140.32 51.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.068 0.461 . . . . 74.12 110.922 178.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -95.64 120.55 36.09 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.242 -0.89 . . . . 64.21 109.789 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 511' ' ' HIS . 0.7 OUTLIER -113.54 121.31 43.83 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.072 0.463 . . . . 74.44 110.964 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -107.51 113.51 26.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.588 -0.733 . . . . 73.31 110.476 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.53 101.4 3.98 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.426 0.631 . . . . 74.0 110.581 174.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 80.06 -131.14 10.3 Favored Glycine 0 N--CA 1.444 -0.83 0 CA-C-N 115.456 -0.793 . . . . 52.24 111.895 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.451 ' HB3' ' O ' ' A' ' 477' ' ' VAL . 26.0 mt-30 -93.47 -10.63 34.34 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.817 0.341 . . . . 61.52 110.567 -178.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.902 ' HB3' ' HG2' ' A' ' 476' ' ' GLU . 25.5 ptt180 -93.52 143.83 25.92 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.546 0.688 . . . . 71.1 111.508 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 54.9 m-70 -124.5 117.71 24.98 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.441 -0.948 . . . . 73.33 108.441 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . 0.564 ' HB2' ' HB2' ' A' ' 504' ' ' LYS . 13.3 m-70 -101.84 127.57 48.59 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.677 -0.238 . . . . 73.31 110.739 -172.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.456 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 63.0 tp -112.7 103.55 11.58 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.596 -0.52 . . . . 73.44 109.596 173.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.852 HG13 ' HG2' ' A' ' 472' ' ' GLU . 1.7 mp -105.08 116.28 48.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.1 -0.5 . . . . 60.43 110.329 179.248 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.728 HG12 ' HB3' ' A' ' 501' ' ' TYR . 53.7 mt -97.81 112.78 30.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.075 -0.713 . . . . 73.5 109.075 175.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -71.19 -44.25 65.82 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.091 -0.504 . . . . 72.32 110.542 -175.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -129.86 109.14 10.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.911 -0.586 . . . . 64.11 109.758 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -89.98 132.16 35.5 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.062 -0.517 . . . . 70.21 110.335 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 26.1 mmt -112.06 166.51 11.18 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.076 -0.511 . . . . 71.33 110.554 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.516 ' H ' HD22 ' A' ' 519' ' ' LEU . 2.9 mm? -58.18 -53.92 52.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.162 -0.472 . . . . 71.21 111.077 -174.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -82.6 -10.78 58.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.075 -0.511 . . . . 74.42 111.651 -176.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -85.9 -14.03 46.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.44 -0.346 . . . . 73.44 110.466 -177.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.644 ' HB2' HG23 ' A' ' 540' ' ' VAL . . . -62.72 -41.98 99.42 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.313 -0.403 . . . . 61.35 111.361 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . 42.68 -158.13 0.08 OUTLIER Glycine 0 C--N 1.337 0.589 0 O-C-N 123.835 0.709 . . . . 60.51 114.472 176.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -126.97 112.38 15.2 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.605 -0.887 . . . . 74.02 108.605 172.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . 0.708 ' HE2' HD11 ' A' ' 493' ' ' LEU . 51.7 m-85 -85.74 131.97 34.22 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.238 0.542 . . . . 75.21 111.494 -172.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -137.55 120.07 16.02 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.553 -0.749 . . . . 64.4 110.035 179.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.54 HD11 ' HB ' ' A' ' 484' ' ' VAL . 45.2 tp -87.6 123.35 32.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.152 -0.476 . . . . 64.31 109.775 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . 0.415 ' SG ' HD13 ' A' ' 487' ' ' LEU . 64.6 m -108.68 112.73 25.19 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.054 0.454 . . . . 64.31 110.202 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.55 ' C ' ' H ' ' A' ' 531' ' ' GLY . 55.1 p -114.61 -165.2 0.99 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.085 -0.507 . . . . 72.53 109.716 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . 0.435 ' HB2' ' H ' ' A' ' 454' ' ' VAL . 2.1 m -49.79 4.53 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 114.087 1.143 . . . . 71.24 114.087 173.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . 0.55 ' H ' ' C ' ' A' ' 529' ' ' THR . . . 120.55 26.84 2.08 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 121.446 0.47 . . . . 74.12 112.789 -173.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -109.04 138.02 14.52 Favored Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 109.21 -1.556 . . . . 73.21 109.21 164.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.74 126.14 46.91 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 117.31 0.555 . . . . 64.3 111.201 -171.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . 0.413 ' HB1' ' H ' ' A' ' 460' ' ' LEU . . . -131.89 133.88 45.09 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.79 -0.641 . . . . 62.32 109.636 174.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.482 HD13 ' N ' ' A' ' 536' ' ' ALA . 1.4 tm? -116.81 133.69 55.7 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.933 -0.395 . . . . 72.13 109.933 -177.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.878 ' HB2' ' HB3' ' A' ' 460' ' ' LEU . . . -122.09 131.22 53.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.431 -0.35 . . . . 44.45 110.801 178.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -102.41 116.41 32.56 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.112 -0.494 . . . . 72.33 110.149 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.506 HD23 ' HA ' ' A' ' 522' ' ' ALA . 33.6 tp -124.11 118.75 27.63 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.266 -0.425 . . . . 72.1 110.088 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.612 ' O ' ' HB2' ' A' ' 464' ' ' LEU . 4.2 mp -124.21 109.68 23.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 109.065 -0.717 . . . . 73.04 109.065 176.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.644 HG23 ' HB2' ' A' ' 522' ' ' ALA . 73.0 t -89.88 129.16 41.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.118 0.485 . . . . 75.51 110.249 -177.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -116.04 168.4 10.12 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.46 -0.791 . . . . 54.44 110.222 -174.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . 0.42 ' HG3' HD11 ' A' ' 519' ' ' LEU . 47.6 mt-10 -115.03 108.68 17.0 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.524 -0.307 . . . . 61.13 110.563 174.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 50.1 pttt . . . . . 0 C--O 1.247 0.93 0 CA-C-N 115.569 -0.742 . . . . 75.04 110.093 177.125 . . . . . . . . 0 0 . 1 stop_ save_