data_2k7l_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 2k7l _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.28 0 CA-C-O 120.728 0.299 . . . . 2.32 111.605 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -51.01 -55.06 19.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.993 0.425 . . . . 1.89 111.626 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.427 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 1.1 p-80 -79.07 -21.85 46.17 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.749 -0.66 . . . . 0.6 111.183 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.561 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 28.2 tp -56.44 -33.37 65.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 1.14 110.811 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.1 mt -85.71 -29.71 6.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.267 -0.424 . . . . 1.33 110.804 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.571 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.74 -44.32 86.34 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.142 -0.481 . . . . 2.23 111.446 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.638 ' O ' HG13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -75.22 -17.94 60.23 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.128 0.489 . . . . 1.14 110.032 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.17 -30.78 71.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.005 -0.543 . . . . 1.77 110.853 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -82.87 -43.92 16.02 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.608 0.596 . . . . 1.85 112.608 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.638 HG13 ' O ' ' B' ' 593' ' ' LEU . 1.6 pp -51.07 -26.61 4.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.059 0.456 . . . . 1.23 111.231 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.659 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.2 tp -71.32 -82.7 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.527 0.68 . . . . 1.13 111.733 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.659 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.439 -1.005 0 CA-C-N 114.565 -1.198 . . . . 1.12 110.642 -177.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.455 HG22 ' CD2' ' A' ' 477' ' ' PHE . 14.2 t . . . . . 0 CA--C 1.516 -0.335 0 CA-C-O 120.976 0.417 . . . . 1.32 110.78 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 28.7 p -131.71 165.34 23.95 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.613 0.72 . . . . 1.09 112.424 -179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.516 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 18.2 mt-10 -60.16 -53.23 60.22 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 114.557 -1.201 . . . . 1.25 110.566 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.32 -28.89 68.49 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.261 -0.881 . . . . 1.29 112.162 -179.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.491 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -71.3 -37.68 71.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.453 -0.34 . . . . 1.07 111.734 -179.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.443 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 21.9 t -72.52 -32.32 41.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.842 -0.343 . . . . 1.11 111.541 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.516 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -58.12 -39.56 79.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.391 -0.368 . . . . 3.05 110.429 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.491 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -67.12 -29.59 69.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 3.01 110.478 179.816 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.443 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 5.0 m-30 -69.27 -39.74 78.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 2.16 110.242 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.556 ' HB2' ' CD2' ' A' ' 515' ' ' LEU . 2.0 mt -69.89 -63.67 1.03 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.706 -0.679 . . . . 1.08 111.733 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.62 -26.31 1.45 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 1.19 110.929 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -88.13 -46.81 8.97 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.896 -0.593 . . . . 3.79 111.221 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.8 OUTLIER -170.06 133.94 1.13 Allowed Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.573 -0.285 . . . . 4.39 110.891 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.662 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 13.9 Cg_endo -54.83 156.22 15.81 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.444 2.096 . . . . 0.84 112.612 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.488 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.47 163.02 39.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.317 0.58 . . . . 1.4 111.899 -179.111 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.502 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 4.3 p -106.11 158.92 16.47 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.819 -1.178 . . . . 1.27 107.819 177.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.5 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.4 OUTLIER -53.49 -46.62 70.08 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.291 -0.564 . . . . 1.23 110.95 -179.658 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.422 ' HG2' ' CD2' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -59.53 -52.02 67.37 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.885 -0.598 . . . . 1.87 110.267 179.171 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -63.61 -32.05 73.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.775 -0.648 . . . . 1.14 111.563 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.488 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 0.9 OUTLIER -71.55 -39.39 70.71 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.998 0.428 . . . . 1.58 111.354 -179.657 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.501 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 1.4 pp -83.59 -43.43 15.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.953 -0.567 . . . . 1.24 111.548 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.29 -33.98 44.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.5 -0.318 . . . . 3.05 111.314 -179.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.434 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -69.52 -39.67 77.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.384 -0.371 . . . . 2.58 111.249 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.455 ' CD2' HG22 ' A' ' 454' ' ' VAL . 15.2 m-85 . . . . . 0 N--CA 1.451 -0.406 0 CA-C-O 121.493 0.663 . . . . 2.12 110.102 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.403 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 3.4 mp . . . . . 0 N--CA 1.449 -0.476 0 CA-C-O 120.94 0.4 . . . . 1.56 111.226 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.55 157.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.748 -0.66 . . . . 1.03 111.688 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.4 -24.35 67.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 1.98 110.154 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.427 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 8.7 mt-10 -90.78 -45.17 8.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.779 -0.646 . . . . 1.53 110.544 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -63.38 -42.78 98.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.58 -0.736 . . . . 1.25 110.052 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 93.4 m -50.19 -28.59 7.76 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.086 0.469 . . . . 1.17 109.747 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 5.1 t -84.73 -41.27 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.562 -0.745 . . . . 1.13 109.982 179.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -57.89 -26.13 61.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.265 -0.88 . . . . 0.47 110.374 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.523 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 3.6 p -101.96 -14.41 8.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.871 -0.604 . . . . 1.07 111.103 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.501 ' CD2' ' HB3' ' A' ' 474' ' ' LEU . 1.4 tp -88.83 -35.98 16.28 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.059 0.456 . . . . 1.63 110.585 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.485 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -56.08 -41.97 75.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.556 . . . . 1.05 111.305 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.523 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.21 -38.59 91.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.864 -0.607 . . . . 0.83 112.259 -179.212 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.526 ' HA ' ' HG2' ' A' ' 499' ' ' ARG . 9.7 mt -79.84 -30.45 13.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 112.922 0.712 . . . . 1.14 112.922 -178.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.5 ' HG ' ' CG2' ' A' ' 470' ' ' THR . 1.1 mm? -49.93 -54.12 21.81 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.048 0.388 . . . . 1.26 112.048 -178.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.473 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.98 -29.97 68.8 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.504 0.557 . . . . 1.34 112.504 -178.336 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.526 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.7 mmm180 -60.48 -22.81 63.93 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.998 0.428 . . . . 2.8 110.475 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.496 ' HB3' ' CD1' ' A' ' 463' ' ' LEU . 77.0 mt -61.15 -47.56 85.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.779 -0.646 . . . . 1.09 111.841 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.608 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.5 t-20 55.89 56.3 9.78 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.028 -0.533 . . . . 0.73 110.051 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.608 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 49.2 Cg_endo -99.55 -160.35 0.04 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 123.965 3.11 . . . . 0.28 111.518 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.81 140.83 49.31 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 116.042 -0.526 . . . . 1.17 109.769 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.57 134.46 36.47 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.384 0.611 . . . . 3.22 111.463 -179.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -156.11 160.14 39.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.105 -0.952 . . . . 1.49 109.727 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 506' ' ' MET . . . . . 0.406 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.7 OUTLIER -105.04 110.09 22.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.875 0.369 . . . . 1.18 111.643 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.514 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.74 110.9 22.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 1.1 109.872 179.04 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 32.6 t30 59.12 44.15 16.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.323 -0.398 . . . . 1.87 110.829 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 72.02 13.08 5.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.121 -0.49 . . . . 1.66 111.414 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.434 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.11 132.95 56.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.616 -0.266 . . . . 1.87 110.885 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.98 108.67 1.56 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.028 0.442 . . . . 1.52 110.747 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.514 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 16.1 m80 -122.75 124.92 44.47 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 2.21 111.026 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.488 ' CD1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.08 123.54 48.16 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.765 -0.457 . . . . 2.17 109.765 178.676 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.662 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER 179.6 169.33 1.12 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.163 0.506 . . . . 1.03 111.936 -178.907 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.556 ' CD2' ' HB2' ' A' ' 463' ' ' LEU . 0.4 OUTLIER -110.83 169.52 8.7 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.541 -0.754 . . . . 2.15 110.249 179.0 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.31 105.39 4.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.172 0.51 . . . . 1.75 110.867 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.244 -0.884 . . . . 3.33 110.993 -179.956 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 120.819 0.342 . . . . 0.0 111.578 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -53.3 -55.02 28.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.021 0.438 . . . . 0.0 111.546 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.41 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 1.0 OUTLIER -79.83 -21.77 43.81 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.254 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.539 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 30.0 tp -50.86 -35.43 32.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.184 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 75.3 mt -85.89 -29.42 6.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.898 0.38 . . . . 0.0 110.908 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.535 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.21 -45.23 95.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.294 -179.793 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.614 ' HA ' HG12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -78.6 -18.53 54.42 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.958 0.409 . . . . 0.0 110.35 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . 0.4 ' N ' HD12 ' B' ' 593' ' ' LEU . 69.1 tt0 -63.19 -30.97 72.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.962 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -82.43 -42.59 18.36 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.614 HG12 ' HA ' ' B' ' 593' ' ' LEU . 1.0 OUTLIER -52.39 -26.79 9.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.224 0.535 . . . . 0.0 111.504 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.624 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 14.3 tp -74.62 -81.07 0.07 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.426 -0.807 . . . . 0.0 112.492 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.624 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.437 -1.105 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.617 -177.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.5 ' CG2' ' CG ' ' A' ' 477' ' ' PHE . 2.7 t . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 120.918 0.39 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 31.4 p -131.91 173.32 11.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.663 0.744 . . . . 0.0 112.605 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.559 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 13.3 mt-10 -69.03 -52.53 27.67 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.574 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -27.82 68.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.175 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . . . . . . . . . . . -65.16 -58.07 6.95 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.974 0.416 . . . . 0.0 111.174 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.506 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 21.7 t -52.29 -25.57 7.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.621 -179.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.2 mmm-85 -62.95 -41.8 99.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.927 0.394 . . . . 0.0 110.468 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -23.92 67.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.597 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.519 ' O ' ' O ' ' A' ' 466' ' ' LYS . 14.7 m-30 -76.04 -44.05 41.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.775 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.553 ' CD1' ' HB3' ' A' ' 500' ' ' LEU . 1.1 mt -65.98 -59.67 3.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.748 0.309 . . . . 0.0 111.328 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -26.21 4.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.039 0.447 . . . . 0.0 110.358 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -88.8 -42.46 11.89 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.724 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.519 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -172.54 161.62 4.07 Favored Pre-proline 0 CA--C 1.531 0.231 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.326 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.625 ' HB2' ' CD2' ' A' ' 512' ' ' HIS . 69.0 Cg_endo -73.3 173.03 14.43 Favored 'Trans proline' 0 N--CA 1.464 -0.252 0 C-N-CA 121.857 1.705 . . . . 0.0 112.91 -179.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.548 ' HG2' ' CG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -166.81 159.77 13.98 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-O 121.703 0.763 . . . . 0.0 112.613 -179.557 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.401 ' C ' HD13 ' A' ' 473' ' ' LEU . 9.2 p -113.51 155.8 24.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.559 -1.201 . . . . 0.0 108.333 177.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.74 -43.75 58.23 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.53 -178.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.587 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -60.86 -56.92 15.49 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.153 0.502 . . . . 0.0 109.973 179.016 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -56.78 -19.87 19.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.963 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.548 ' CG ' ' HG2' ' A' ' 468' ' ' MET . 5.9 mt -81.69 -37.89 26.68 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -179.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 471' ' ' LYS . 0.4 OUTLIER -84.05 -42.53 16.04 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -178.719 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 26.3 mmtm -47.21 -27.41 1.48 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.686 0.279 . . . . 0.0 111.612 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -87.33 -40.27 14.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.996 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.5 ' CG ' ' CG2' ' A' ' 454' ' ' VAL . 15.7 m-85 . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 9.1 tp . . . . . 0 N--CA 1.452 -0.367 0 CA-C-O 120.962 0.41 . . . . 0.0 111.395 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.94 144.04 3.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.4 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 39.4 t -59.27 -20.03 50.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.786 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.41 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 9.7 mt-10 -94.61 -43.53 8.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.087 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -68.88 -40.75 79.05 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.184 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 41.4 m -50.87 -28.79 10.3 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 3.5 t -82.01 -41.96 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.395 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -59.52 -28.16 66.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.302 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.478 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 6.3 p -102.02 -6.95 9.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.019 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.502 ' HB2' ' O ' ' A' ' 489' ' ' THR . 10.2 tp -94.27 -44.77 7.8 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.801 0.334 . . . . 0.0 110.936 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -51.92 -38.1 55.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.207 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.478 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -61.32 -40.08 92.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.185 -179.368 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.559 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 10.5 mt -74.95 -50.14 26.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.494 ' CD1' ' CD1' ' A' ' 473' ' ' LEU . 0.5 OUTLIER -32.2 -44.15 0.09 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -178.194 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.557 ' HA ' ' CD1' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -70.1 -38.16 75.59 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.551 ' HG3' ' HG2' ' A' ' 456' ' ' GLU . 1.4 mmm180 -58.79 -20.81 53.31 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.963 0.411 . . . . 0.0 110.578 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.553 ' HB3' ' CD1' ' A' ' 463' ' ' LEU . 67.4 mt -57.85 -47.58 82.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.86 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.553 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.7 t-20 60.58 58.85 3.92 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.143 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.553 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.0 Cg_endo -101.14 -162.71 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 124.168 3.245 . . . . 0.0 111.943 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.1 138.35 54.23 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.418 178.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.63 131.48 35.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.56 0.695 . . . . 0.0 112.104 -178.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.581 ' HE3' ' CE1' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -156.6 160.43 39.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.307 179.43 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.19 108.88 20.66 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.633 HG12 ' ND1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -89.62 110.81 22.18 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.52 178.185 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 64.28 42.53 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.154 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.3 t0 67.21 20.07 10.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.354 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.419 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.13 130.02 56.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.653 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 7.1 tpt -62.75 106.94 0.87 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.732 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.633 ' ND1' HG12 ' A' ' 507' ' ' ILE . 0.0 OUTLIER -124.55 156.15 37.84 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.883 -179.251 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.498 ' CE1' HD22 ' B' ' 597' ' ' LEU . 0.2 OUTLIER -133.21 122.42 23.94 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.674 177.733 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.624 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -177.76 169.33 2.07 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.064 0.459 . . . . 0.0 111.513 -179.456 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.52 ' CD2' ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -123.67 168.0 13.24 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.935 178.59 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.488 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -137.87 106.28 5.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.976 179.558 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.159 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 120.75 0.31 . . . . 0.0 111.579 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -51.7 -55.19 20.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.094 0.473 . . . . 0.0 111.769 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.623 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.1 p-80 -78.69 -21.94 47.46 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.239 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.568 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 24.3 tp -58.83 -29.49 66.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.08 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 86.2 mt -85.96 -32.54 6.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.623 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.2 OUTLIER -71.71 -38.37 70.54 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.388 -0.525 . . . . 0.0 112.158 -178.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.659 ' O ' HG13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -70.58 -17.97 62.9 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.112 179.964 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -62.25 -30.68 71.29 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.739 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . 0.416 ' CG ' ' O ' ' B' ' 592' ' ' TYR . 1.5 pt-20 -82.82 -42.96 17.22 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -179.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.659 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.0 pp -52.48 -26.48 9.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.228 0.537 . . . . 0.0 110.816 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.649 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.4 tp -72.85 -82.27 0.05 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.249 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.649 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 31.2 m . . . . . 0 N--CA 1.438 -1.052 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.757 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.469 HG22 ' CD2' ' A' ' 477' ' ' PHE . 26.6 t . . . . . 0 CA--C 1.518 -0.285 0 CA-C-O 120.918 0.389 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 30.2 p -131.65 167.69 19.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.716 0.77 . . . . 0.0 112.479 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.454 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 22.1 mt-10 -62.94 -53.08 59.62 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.645 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -27.42 68.82 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.533 -178.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.448 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -66.66 -58.34 5.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.911 0.386 . . . . 0.0 111.238 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.506 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 16.9 t -49.76 -31.68 6.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.187 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.0 OUTLIER -55.54 -47.31 76.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.396 178.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -60.73 -26.79 67.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.939 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.506 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 4.3 m-30 -73.35 -45.35 55.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.048 0.451 . . . . 0.0 110.314 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.495 ' HB2' HD22 ' A' ' 515' ' ' LEU . 2.5 mt -67.2 -58.46 4.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.842 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.11 -23.84 6.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.908 0.385 . . . . 0.0 110.924 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 -93.44 -44.24 8.35 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.308 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.435 ' HE2' ' HG2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -168.15 134.02 1.59 Allowed Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.005 -179.761 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.533 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 30.6 Cg_endo -60.94 142.11 96.57 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.244 1.963 . . . . 0.0 112.607 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.425 ' HE1' ' O ' ' A' ' 513' ' ' PHE . 0.0 OUTLIER -128.07 178.74 6.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.329 -179.422 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.418 HG23 ' CE1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -119.34 154.26 33.85 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 177.369 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.488 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -51.24 -44.66 61.75 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.04 -0.664 . . . . 0.0 110.839 -179.34 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.571 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -65.6 -54.8 22.72 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.484 178.514 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -58.65 -21.16 53.33 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.704 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.608 HD13 HD11 ' A' ' 497' ' ' LEU . 0.4 OUTLIER -80.14 -40.65 26.95 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 121.106 0.479 . . . . 0.0 111.628 -179.606 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.499 ' HA ' HD13 ' A' ' 493' ' ' LEU . 0.9 OUTLIER -83.8 -48.53 9.98 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.58 -178.968 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 29.9 mmtp -48.8 -26.72 2.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.693 0.282 . . . . 0.0 111.667 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.423 ' HE2' ' CE2' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -78.84 -36.16 42.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.1 179.869 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.469 ' CD2' HG22 ' A' ' 454' ' ' VAL . 11.5 m-85 . . . . . 0 CA--C 1.519 -0.212 0 CA-C-O 121.371 0.605 . . . . 0.0 111.009 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 N--CA 1.45 -0.474 0 CA-C-O 121.018 0.437 . . . . 0.0 111.352 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.42 154.7 1.7 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.581 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 53.2 p -62.31 -23.54 66.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.019 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.457 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 14.8 mt-10 -87.44 -51.97 5.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.558 179.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -62.02 -41.79 98.46 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.353 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.568 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 62.0 m -49.13 -39.69 29.53 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . 0.406 ' CG1' ' HG ' ' B' ' 593' ' ' LEU . 2.3 t -66.42 -49.96 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.385 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.01 -28.36 9.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.762 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.546 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.1 p -102.04 -13.8 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.011 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.568 ' HB2' ' O ' ' A' ' 489' ' ' THR . 0.4 OUTLIER -89.49 -41.19 12.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 120.751 0.31 . . . . 0.0 110.841 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.443 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -50.52 -41.2 53.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.08 0.467 . . . . 0.0 110.774 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.546 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -65.85 -40.06 91.37 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.375 -179.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.452 HG13 ' NE2' ' A' ' 495' ' ' GLN . 8.4 mt -75.84 -39.17 37.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.914 -179.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.608 HD11 HD13 ' A' ' 473' ' ' LEU . 2.4 mm? -42.95 -60.34 1.66 Allowed 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -178.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.531 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.79 -28.76 67.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.862 0.363 . . . . 0.0 111.522 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -27.07 66.08 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.172 0.51 . . . . 0.0 110.609 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.41 HD23 ' CD ' ' A' ' 460' ' ' ARG . 45.0 mt -60.58 -47.41 86.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.744 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.568 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.2 t-20 57.22 58.25 7.8 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.743 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.568 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 78.7 Cg_endo -101.31 -159.63 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.428 0 C-N-CA 124.039 3.159 . . . . 0.0 111.504 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.0 141.8 48.07 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.927 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 4.3 ppt_? -79.58 135.32 36.57 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.293 0.568 . . . . 0.0 111.315 -179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.4 mtmt -155.57 134.65 12.17 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.698 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 506' ' ' MET . . . . . 0.424 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 12.4 ptm -82.83 110.43 17.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.013 0.435 . . . . 0.0 111.636 -179.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.464 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.68 111.0 22.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.748 178.973 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 58.9 t30 60.4 38.72 19.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.913 0.387 . . . . 0.0 110.464 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 3.5 t0 78.58 11.79 1.62 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.408 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.442 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.26 125.48 52.26 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.694 0.283 . . . . 0.0 111.271 179.83 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.47 109.07 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.987 0.422 . . . . 0.0 110.954 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.464 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 9.2 m80 -120.43 138.72 53.63 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.722 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.556 ' CD2' ' CD2' ' B' ' 597' ' ' LEU . 0.0 OUTLIER -107.49 124.17 49.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.279 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.533 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.6 OUTLIER -170.34 169.36 7.63 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.606 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.1 pt? -128.9 169.02 15.13 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.893 -1.048 . . . . 0.0 108.997 178.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.67 106.54 8.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.017 0.437 . . . . 0.0 111.289 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.251 -0.88 . . . . 0.0 111.02 -179.959 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' B' ' 590' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.078 0 CA-C-O 120.823 0.344 . . . . 0.0 111.565 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -50.86 -44.65 59.64 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.921 0.391 . . . . 0.0 111.331 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -80.31 -21.93 42.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.577 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.526 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 24.6 tp -55.86 -31.74 63.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.998 0.428 . . . . 0.0 110.861 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.1 mt -85.91 -29.53 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.998 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.544 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.77 -39.81 91.39 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.634 -179.436 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.544 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -78.63 -18.58 54.28 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.084 0.468 . . . . 0.0 110.037 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -63.53 -34.19 77.25 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.445 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -76.68 -44.7 32.6 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -178.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.512 HG12 ' HA ' ' B' ' 593' ' ' LEU . 2.9 pt -50.66 -26.87 4.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 121.158 0.504 . . . . 0.0 111.789 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.629 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.9 tp -75.36 -80.67 0.08 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.43 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.629 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.437 -1.116 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.602 -177.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.43 HG23 ' CD2' ' A' ' 477' ' ' PHE . 12.5 t . . . . . 0 CA--C 1.516 -0.332 0 CA-C-O 120.971 0.415 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 455' ' ' THR . . . . . 0.4 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.8 p -131.78 165.97 22.59 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.607 0.717 . . . . 0.0 112.485 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.565 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 16.9 mt-10 -61.24 -53.74 53.01 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.54 179.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.49 -28.07 65.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.206 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . . . . . . . . . . . -74.1 -38.26 63.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.701 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' A' ' 463' ' ' LEU . 15.7 t -70.59 -37.92 71.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.206 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.565 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 2.0 mmm-85 -52.54 -54.82 27.61 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.452 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -56.45 -27.46 56.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.85 179.497 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.468 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 17.5 m-30 -73.52 -46.96 44.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.13 179.091 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.512 HD11 ' HB3' ' A' ' 500' ' ' LEU . 2.1 mt -65.79 -57.44 7.97 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.407 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -48.27 -27.54 2.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.11 0.481 . . . . 0.0 110.421 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.494 ' O ' ' HG2' ' A' ' 466' ' ' LYS . 10.8 ttt85 -88.58 -54.08 4.34 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.648 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.53 ' HD3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -158.81 152.13 18.84 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.974 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.542 ' HB2' ' HB3' ' A' ' 512' ' ' HIS . 80.9 Cg_endo -72.97 175.86 9.85 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.619 2.213 . . . . 0.0 112.94 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.634 ' HG3' ' CD2' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -168.46 166.25 12.28 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.204 0.526 . . . . 0.0 112.044 -178.719 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.551 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 4.1 p -105.36 154.97 19.57 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 177.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.457 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.0 OUTLIER -55.64 -33.71 64.29 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.141 -179.564 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.42 ' HB3' HD23 ' B' ' 590' ' ' LEU . 0.1 OUTLIER -69.38 -52.03 31.02 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.309 0.576 . . . . 0.0 109.463 178.9 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -58.82 -31.13 68.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.378 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.634 ' CD2' ' HG3' ' A' ' 468' ' ' MET . 3.2 mt -64.7 -48.58 74.15 Favored 'General case' 0 CA--C 1.522 -0.099 0 CA-C-O 120.939 0.399 . . . . 0.0 111.271 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.435 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 0.8 OUTLIER -79.67 -32.09 41.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.956 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.401 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -58.73 -26.83 64.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.175 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -86.28 -43.05 13.24 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.587 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.465 ' CE2' ' HE2' ' A' ' 476' ' ' LYS . 12.8 m-85 . . . . . 0 N--CA 1.451 -0.42 0 CA-C-O 121.488 0.661 . . . . 0.0 110.192 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 3.3 mp . . . . . 0 N--CA 1.45 -0.435 0 CA-C-O 120.914 0.388 . . . . 0.0 111.277 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -41.37 152.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.913 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 p -61.56 -24.72 66.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.07 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -84.36 -53.51 5.41 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.531 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -59.93 -43.46 94.92 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.034 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.41 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 54.9 m -47.78 -32.26 5.79 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-O 121.194 0.521 . . . . 0.0 109.704 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 3.9 t -75.62 -45.47 38.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.04 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -56.51 -27.36 57.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.118 179.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.528 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 8.3 p -102.11 -12.77 8.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.087 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.462 ' CD1' ' CD2' ' A' ' 497' ' ' LEU . 10.2 tp -89.39 -41.3 12.19 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.786 0.327 . . . . 0.0 110.913 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.58 ' O ' ' NZ ' ' A' ' 498' ' ' LYS . . . -53.99 -41.04 67.48 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.013 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.7 OUTLIER -57.17 -41.37 79.13 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.432 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.534 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 8.8 mt -79.84 -31.2 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -177.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.462 ' CD2' ' CD1' ' A' ' 493' ' ' LEU . 1.7 mm? -51.07 -50.29 58.98 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -178.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.58 ' NZ ' ' O ' ' A' ' 494' ' ' ALA . 0.0 OUTLIER -69.44 -24.26 63.79 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -177.875 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.482 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 10.5 mmm-85 -61.94 -19.58 62.88 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.226 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.512 ' HB3' HD11 ' A' ' 463' ' ' LEU . 23.1 mt -66.08 -47.68 73.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.26 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.549 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.5 t-20 56.96 59.37 7.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.547 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.549 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 84.4 Cg_endo -101.02 -157.96 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.375 0 C-N-CA 123.918 3.079 . . . . 0.0 111.465 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.08 139.66 53.02 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.082 179.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.62 135.75 36.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.258 0.551 . . . . 0.0 111.478 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -154.72 160.08 41.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.733 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -104.97 108.9 20.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.902 0.382 . . . . 0.0 111.691 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.471 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.92 110.82 22.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.067 178.951 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 58.88 44.22 16.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.056 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.1 t70 74.32 8.1 4.57 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.47 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.45 ' O ' ' N ' ' A' ' 507' ' ' ILE . 1.5 tpmt? -113.48 130.79 56.25 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-O 120.651 0.262 . . . . 0.0 110.754 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 5.4 tpt -67.54 108.69 2.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.051 0.453 . . . . 0.0 110.994 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.551 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 12.0 m170 -122.45 138.17 54.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.632 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.496 ' CE2' ' CD2' ' B' ' 597' ' ' LEU . 0.0 OUTLIER -105.15 133.2 50.31 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.53 ' HB2' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -176.87 169.24 2.46 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.918 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.602 ' N ' HD21 ' A' ' 515' ' ' LEU . 1.3 pt? -129.76 168.9 15.84 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.196 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.12 106.48 7.64 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.01 0.434 . . . . 0.0 111.438 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.827 179.926 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.741 0.305 . . . . 0.0 111.752 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 -50.48 -45.77 56.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.93 0.395 . . . . 0.0 111.354 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.701 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.9 p-80 -80.29 -21.88 42.18 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.351 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.543 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 24.7 tp -64.99 -28.99 69.89 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.324 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 77.9 mt -85.51 -32.71 7.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.701 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.58 -39.29 70.66 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.464 -0.495 . . . . 0.0 111.837 -179.243 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.656 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -70.72 -17.9 62.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.202 0.525 . . . . 0.0 110.081 -179.822 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . 0.447 ' HA ' HG21 ' A' ' 470' ' ' THR . 3.8 pt-20 -63.21 -30.8 71.87 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.012 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -83.01 -43.0 16.86 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.642 HG13 ' O ' ' B' ' 593' ' ' LEU . 1.9 pp -52.22 -26.59 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.196 0.522 . . . . 0.0 110.935 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.679 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 11.8 tp -69.56 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.336 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.679 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.44 -0.974 0 CA-C-N 114.693 -1.139 . . . . 0.0 110.575 -178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.419 HG21 ' CD2' ' A' ' 477' ' ' PHE . 19.3 t . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 121.008 0.432 . . . . 0.0 110.674 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 26.3 p -131.55 173.39 11.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.644 0.735 . . . . 0.0 112.66 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.583 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 15.1 mt-10 -68.04 -53.07 28.5 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.385 179.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.83 -28.8 62.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.192 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -70.04 -58.24 4.05 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.748 0.309 . . . . 0.0 111.347 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.494 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 19.2 t -51.75 -26.31 6.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.759 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.583 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.3 mmm-85 -63.09 -44.42 95.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.804 0.335 . . . . 0.0 110.336 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -61.74 -24.98 67.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.504 179.684 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.494 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 4.0 m-30 -71.61 -46.37 59.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.998 0.428 . . . . 0.0 110.153 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.537 ' CB ' HD13 ' A' ' 515' ' ' LEU . 0.4 OUTLIER -65.91 -58.29 5.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.479 -179.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -23.92 2.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.932 0.396 . . . . 0.0 110.599 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.5 mtt85 -94.11 -42.67 8.87 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.417 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.457 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -173.36 156.28 2.85 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 120.766 0.317 . . . . 0.0 111.27 -179.737 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.662 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 71.8 Cg_endo -73.62 147.3 40.21 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.743 2.295 . . . . 0.0 113.463 -179.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.454 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -143.35 149.58 37.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.846 -179.702 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.458 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 12.1 p -90.14 177.37 6.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 176.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.447 HG21 ' HA ' ' B' ' 594' ' ' GLU . 0.5 OUTLIER -70.97 -34.96 71.92 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.147 -0.621 . . . . 0.0 111.06 -179.735 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.414 ' HG2' ' CD2' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -72.48 -49.5 32.69 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.661 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -60.77 -34.49 74.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.691 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.454 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 0.9 OUTLIER -64.19 -42.22 96.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.973 0.416 . . . . 0.0 110.9 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.478 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 3.0 pp -84.13 -33.06 24.37 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.741 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.06 -26.83 2.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.617 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.45 ' CE ' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -86.09 -43.63 12.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.492 -179.825 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.45 ' CD2' ' CE ' ' A' ' 476' ' ' LYS . 5.4 m-85 . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 121.112 0.482 . . . . 0.0 111.406 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.415 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 1.1 mp . . . . . 0 N--CA 1.449 -0.519 0 CA-C-O 121.016 0.436 . . . . 0.0 111.028 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.78 155.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.709 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.5 m -60.63 -22.64 64.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.129 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.457 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 8.6 mt-10 -91.23 -44.93 8.92 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.61 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . 0.431 ' HA ' ' HB3' ' A' ' 491' ' ' ASN . 2.2 mt-30 -65.41 -40.62 93.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.115 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 70.2 m -51.02 -28.57 10.4 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.21 0.529 . . . . 0.0 109.595 178.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 14.4 t -84.97 -41.64 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.831 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . 0.431 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 7.1 t30 -60.96 -29.22 69.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.025 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.521 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.3 p -98.6 -7.25 9.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.924 179.477 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.498 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 39.2 tp -94.61 -46.89 6.76 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 121.029 0.442 . . . . 0.0 110.714 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.47 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -49.74 -34.12 18.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.401 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.7 OUTLIER -68.35 -44.07 76.09 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.72 -179.493 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.527 ' HA ' ' HG2' ' A' ' 499' ' ' ARG . 9.5 mt -79.39 -32.64 14.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.498 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.0 OUTLIER -44.12 -56.99 3.65 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.589 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.46 ' H ' ' HD2' ' A' ' 498' ' ' LYS . 0.0 OUTLIER -59.9 -33.36 71.75 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -178.097 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.527 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 14.3 mmm180 -56.64 -22.18 32.44 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.981 0.42 . . . . 0.0 110.814 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.501 ' HB3' HD12 ' A' ' 463' ' ' LEU . 93.6 mt -59.64 -47.6 84.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.171 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.589 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.0 t-20 58.36 57.48 6.41 Favored Pre-proline 0 C--N 1.32 -0.716 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.311 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.589 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 56.5 Cg_endo -99.84 -159.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 124.137 3.225 . . . . 0.0 111.363 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.8 139.78 52.65 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.771 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 5.3 ptt-85 -79.64 133.44 36.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.488 0.661 . . . . 0.0 111.5 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -156.25 160.21 39.58 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.664 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -103.86 110.39 22.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.995 0.426 . . . . 0.0 111.502 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.462 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.64 110.86 22.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.942 179.085 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.3 t30 59.8 43.13 15.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.841 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 73.28 12.36 4.85 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.35 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.418 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -116.1 131.38 56.96 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.866 179.826 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 28.9 mmm -62.9 108.49 1.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.061 0.457 . . . . 0.0 110.552 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.462 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 23.7 m80 -122.76 125.52 45.65 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.081 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.512 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -104.92 123.37 47.63 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 178.71 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.662 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER 179.43 169.37 1.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.08 0.467 . . . . 0.0 111.33 -178.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.537 HD13 ' CB ' ' A' ' 463' ' ' LEU . 0.0 OUTLIER -118.78 168.7 10.5 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.641 178.547 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.495 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -136.9 106.05 6.0 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.082 0.467 . . . . 0.0 111.219 179.54 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.087 179.958 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 . . . . . 0 N--CA 1.451 -0.415 0 CA-C-O 120.823 0.344 . . . . 0.0 111.541 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -56.15 -55.25 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.083 0.468 . . . . 0.0 111.699 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.676 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.5 p-80 -76.57 -21.97 54.93 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.319 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.56 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 19.5 tp -61.06 -29.32 69.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.452 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 82.6 mt -85.92 -34.4 8.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.676 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.4 OUTLIER -71.53 -40.74 69.87 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 120.51 -0.476 . . . . 0.0 112.163 -178.812 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.666 ' O ' HG13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -65.4 -18.62 65.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.211 0.529 . . . . 0.0 110.052 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . 0.468 ' HA ' HG22 ' A' ' 470' ' ' THR . 14.3 tt0 -63.62 -30.41 71.52 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.551 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.52 -48.05 18.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.241 -178.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.666 HG13 ' O ' ' B' ' 593' ' ' LEU . 1.6 pp -51.16 -26.68 5.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.103 0.478 . . . . 0.0 110.94 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.628 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 14.2 tp -62.48 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.541 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.628 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 34.9 m . . . . . 0 N--CA 1.438 -1.06 0 CA-C-N 114.877 -1.056 . . . . 0.0 111.245 -177.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.426 HG23 ' CD2' ' A' ' 477' ' ' PHE . 2.1 t . . . . . 0 CA--C 1.518 -0.264 0 CA-C-O 120.996 0.427 . . . . 0.0 110.802 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 455' ' ' THR . . . . . 0.422 ' O ' HG21 ' A' ' 459' ' ' VAL . 28.2 p -131.65 167.97 18.54 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.585 0.707 . . . . 0.0 112.533 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.534 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 17.7 mt-10 -65.1 -54.87 23.33 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.188 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -50.59 -28.39 8.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.654 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.412 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -76.92 -35.83 57.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.762 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.45 HG21 HG21 ' A' ' 496' ' ' ILE . 13.2 t -76.1 -31.89 22.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.709 0.29 . . . . 0.0 111.446 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.534 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.1 mmm180 -61.43 -41.24 96.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.211 179.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.454 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -65.81 -29.01 69.42 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.407 179.275 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.454 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 11.4 m-30 -64.3 -45.74 86.66 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.637 HD13 ' HB3' ' A' ' 500' ' ' LEU . 0.4 OUTLIER -64.56 -59.05 4.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.876 179.534 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.82 -26.6 1.7 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.234 179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -88.89 -49.32 6.87 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.809 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.423 ' HD3' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -171.78 162.81 4.72 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.114 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.553 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 97.4 Cg_endo -80.37 160.08 22.82 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.763 2.309 . . . . 0.0 113.292 -179.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.449 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -157.21 168.2 28.11 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.369 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.497 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 4.6 p -100.75 176.1 5.42 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 176.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.468 HG22 ' HA ' ' B' ' 594' ' ' GLU . 0.1 OUTLIER -71.33 -30.85 66.69 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 119.992 -0.683 . . . . 0.0 111.401 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.547 ' HD2' ' H ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -77.17 -50.17 13.56 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.569 0.699 . . . . 0.0 109.388 178.53 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -57.91 -31.4 66.73 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.12 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.449 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 0.9 OUTLIER -70.49 -39.22 74.31 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-O 120.989 0.423 . . . . 0.0 110.664 179.852 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.556 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 2.1 pp -84.2 -33.15 24.22 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.938 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.42 -27.67 1.79 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.372 -179.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.432 ' HE2' ' CE2' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -85.35 -43.08 13.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.171 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.429 ' CD2' ' HE3' ' A' ' 476' ' ' LYS . 10.0 m-85 . . . . . 0 N--CA 1.455 -0.214 0 CA-C-O 121.109 0.48 . . . . 0.0 111.26 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 120.937 0.398 . . . . 0.0 111.131 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -43.9 149.93 0.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.669 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.76 -21.65 61.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.467 179.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.439 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 12.6 mt-10 -91.59 -49.17 6.44 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.716 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -62.57 -42.09 99.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.31 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 87.1 m -49.11 -29.6 5.47 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.246 0.546 . . . . 0.0 109.692 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . 0.408 ' CG1' ' HG ' ' B' ' 593' ' ' LEU . 13.7 t -83.12 -41.99 17.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.061 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -59.81 -31.97 70.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.063 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.505 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.6 p -94.86 -11.62 8.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.825 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.57 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 11.5 tp -90.22 -44.89 9.44 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.926 0.393 . . . . 0.0 110.777 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.512 ' HB2' ' HB2' ' B' ' 593' ' ' LEU . . . -50.76 -33.9 25.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.569 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.505 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -67.81 -40.56 83.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.789 -179.279 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.5 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 8.7 mt -77.99 -43.42 28.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.57 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.2 OUTLIER -37.77 -56.24 1.1 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -178.466 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.476 ' H ' ' HD2' ' A' ' 498' ' ' LYS . 0.0 OUTLIER -59.78 -23.56 63.38 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.557 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.454 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 0.1 OUTLIER -64.74 -18.53 65.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.137 0.494 . . . . 0.0 110.204 179.114 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.637 ' HB3' HD13 ' A' ' 463' ' ' LEU . 29.9 mt -59.7 -47.59 85.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.104 -179.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.639 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.8 t-20 56.63 54.99 8.24 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.287 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.639 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.2 Cg_endo -101.41 -160.27 0.04 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 124.249 3.3 . . . . 0.0 111.67 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.75 141.29 48.76 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.658 178.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.64 133.55 36.4 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.4 0.619 . . . . 0.0 111.512 -178.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -156.29 160.18 39.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.007 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.12 109.78 21.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.866 0.365 . . . . 0.0 111.347 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.438 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -90.73 110.86 22.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.021 179.071 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 58.6 t30 58.88 44.91 15.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.804 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.2 t70 71.57 13.24 6.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.201 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -116.09 127.59 54.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.636 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.16 108.51 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.921 0.391 . . . . 0.0 110.438 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.497 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 9.0 m-70 -122.47 128.22 50.58 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.946 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.54 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -104.89 122.88 46.71 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.733 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.553 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER 179.25 169.33 1.01 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.069 0.461 . . . . 0.0 111.437 -178.757 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.552 HD12 ' CB ' ' A' ' 463' ' ' LEU . 0.0 OUTLIER -120.34 168.88 10.83 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.521 178.331 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.488 ' N ' HD23 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -134.01 106.15 7.09 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.136 0.494 . . . . 0.0 111.204 179.605 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.057 179.887 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.779 0.323 . . . . 0.0 111.597 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -50.93 -55.21 18.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.953 0.406 . . . . 0.0 111.719 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.46 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 0.5 OUTLIER -80.11 -21.9 42.75 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.164 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.64 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 39.7 tp -54.43 -47.6 72.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.004 0.43 . . . . 0.0 110.859 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 48.9 mt -86.24 -29.6 6.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.785 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.584 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.06 -45.46 77.29 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.387 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.64 ' CD1' ' O ' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -67.96 -20.34 65.05 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.172 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -63.44 -30.86 71.92 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.323 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.83 -45.83 63.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.532 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.497 ' CG1' ' O ' ' B' ' 593' ' ' LEU . 5.1 pt -58.14 -26.62 29.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.307 0.575 . . . . 0.0 110.678 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.637 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 12.2 tp -72.31 -81.74 0.05 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.1 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.637 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.7 m . . . . . 0 N--CA 1.438 -1.059 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.593 -177.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.457 ' CG2' ' CD2' ' A' ' 477' ' ' PHE . 2.2 t . . . . . 0 CA--C 1.519 -0.227 0 CA-C-O 120.83 0.348 . . . . 0.0 110.382 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 35.0 p -131.49 170.71 14.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.689 0.757 . . . . 0.0 112.779 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.516 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 23.8 mt-10 -69.06 -52.97 22.98 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.328 -1.305 . . . . 0.0 110.73 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.92 -27.5 68.86 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.314 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.44 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -69.71 -36.71 76.15 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.458 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.52 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 15.6 t -70.67 -36.92 67.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.808 0.337 . . . . 0.0 110.911 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.423 ' CD ' HD22 ' A' ' 500' ' ' LEU . 1.5 mmm-85 -52.76 -49.56 65.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.953 178.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.504 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -61.66 -23.74 66.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.014 179.8 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.52 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 8.4 m-30 -75.17 -42.62 55.57 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.223 0.535 . . . . 0.0 109.605 178.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.475 HD12 ' CD2' ' A' ' 515' ' ' LEU . 1.8 mt -69.46 -57.66 4.97 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.454 -179.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -48.28 -27.58 2.58 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.091 0.472 . . . . 0.0 110.364 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.645 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 15.2 mtt180 -83.96 -55.75 4.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.517 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.645 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER -163.72 146.37 7.78 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.657 -179.936 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.593 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 43.9 Cg_endo -68.1 161.52 44.05 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.64 2.227 . . . . 0.0 113.139 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.536 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -159.64 166.61 30.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.567 -179.227 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.488 HG22 ' CD2' ' A' ' 512' ' ' HIS . 51.8 p -98.73 178.56 4.94 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.19 -40.74 71.02 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.612 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.52 ' H ' ' CD ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -64.47 -52.2 59.19 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.264 0.554 . . . . 0.0 109.852 179.013 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . 0.426 ' H ' ' HG2' ' A' ' 471' ' ' LYS . 46.3 t0 -59.94 -25.04 64.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.621 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.536 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 1.4 tt -86.13 -45.47 11.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.004 0.431 . . . . 0.0 111.616 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.482 ' HA ' ' CD2' ' A' ' 493' ' ' LEU . 3.6 pp -76.09 -44.1 40.36 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.087 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 471' ' ' LYS . 0.1 OUTLIER -52.34 -24.27 7.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.681 0.277 . . . . 0.0 111.204 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.587 ' HG2' ' N ' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -76.99 -44.43 31.09 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.521 -179.424 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.587 ' N ' ' HG2' ' A' ' 476' ' ' LYS . 9.1 m-85 . . . . . 0 CA--C 1.513 -0.466 0 CA-C-O 121.593 0.711 . . . . 0.0 109.753 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.408 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 5.0 mp . . . . . 0 N--CA 1.448 -0.552 0 CA-C-O 120.963 0.411 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.66 158.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.704 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 14.7 m -60.84 -27.2 67.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.127 0.489 . . . . 0.0 110.089 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.46 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 4.3 mt-10 -86.95 -46.63 9.69 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.415 179.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -63.2 -40.34 97.21 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.0 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.446 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 96.7 m -50.71 -28.07 8.32 Favored 'General case' 0 C--N 1.335 -0.058 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 4.6 t -82.05 -44.16 19.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.107 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -56.31 -25.85 50.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.754 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.51 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 6.9 p -100.31 -14.17 7.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.546 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.482 ' CD2' ' HA ' ' A' ' 474' ' ' LEU . 0.2 OUTLIER -91.0 -35.22 14.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.888 0.375 . . . . 0.0 110.91 -179.776 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.49 ' HB1' HD12 ' B' ' 596' ' ' ILE . . . -58.33 -38.54 77.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.273 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.6 OUTLIER -63.13 -40.83 98.72 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.424 -179.614 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.516 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 8.3 mt -79.02 -44.31 24.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.569 -178.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.463 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 2.3 mm? -41.15 -50.91 3.5 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.526 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -64.26 -33.17 75.21 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.873 0.368 . . . . 0.0 111.948 -178.768 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.465 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 0.7 OUTLIER -55.9 -23.3 30.53 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.003 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.434 ' HB3' HD13 ' A' ' 463' ' ' LEU . 56.8 mt -59.99 -47.54 85.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.924 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.539 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 24.9 t-20 58.13 59.94 6.18 Favored Pre-proline 0 C--N 1.32 -0.715 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.503 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.539 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 84.7 Cg_endo -101.06 -157.29 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.306 0 C-N-CA 123.966 3.111 . . . . 0.0 111.419 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.01 140.44 51.91 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.012 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.8 135.14 36.41 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.337 0.589 . . . . 0.0 111.579 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 14.7 mtmt -156.11 159.26 38.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.587 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 506' ' ' MET . . . . . 0.407 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -105.17 111.65 24.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.031 0.443 . . . . 0.0 111.722 -179.64 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.531 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.89 110.94 22.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.001 179.0 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 9.4 t30 58.62 42.96 19.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.836 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 74.45 12.38 3.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.391 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 506' ' ' MET . 0.0 OUTLIER -116.17 130.96 57.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.854 179.824 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.97 109.1 1.68 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.962 0.41 . . . . 0.0 111.022 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.488 ' CD2' HG22 ' A' ' 469' ' ' THR . 11.1 m170 -122.31 138.21 54.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.886 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.504 ' CE2' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -111.13 128.33 55.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.114 179.408 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.593 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -179.89 169.24 1.28 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.239 0.542 . . . . 0.0 112.16 -179.097 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.531 HD22 ' N ' ' A' ' 515' ' ' LEU . 1.2 pt? -122.03 169.19 11.08 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.206 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.6 106.62 8.3 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.418 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.107 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.379 0 CA-C-O 120.871 0.367 . . . . 0.0 111.617 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -52.06 -55.26 21.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.744 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.694 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.2 p-80 -77.63 -21.86 51.61 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.251 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.529 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 23.4 tp -61.93 -29.46 70.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.344 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . 0.425 HG21 HD12 ' B' ' 591' ' ' ILE . 76.0 mt -85.97 -34.64 8.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.694 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.67 -43.54 65.84 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 120.346 -0.542 . . . . 0.0 112.065 -179.018 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.683 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -64.08 -18.85 64.79 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.166 -179.656 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -63.55 -30.74 71.81 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . 0.401 ' HG3' ' H ' ' B' ' 596' ' ' ILE . 0.3 OUTLIER -74.8 -48.48 25.14 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.97 -179.357 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.625 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.1 pp -53.72 -26.52 13.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.275 0.559 . . . . 0.0 110.721 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.64 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.1 tp -71.85 -82.44 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.969 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.64 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.4 m . . . . . 0 N--CA 1.438 -1.041 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.76 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.431 HG23 ' CD2' ' A' ' 477' ' ' PHE . 3.9 t . . . . . 0 CA--C 1.518 -0.287 0 CA-C-O 120.879 0.371 . . . . 0.0 110.693 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 32.5 p -131.77 168.14 18.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.68 0.752 . . . . 0.0 112.578 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.483 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 20.9 mt-10 -61.59 -53.33 57.65 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.359 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.12 -27.86 69.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.237 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.438 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -68.54 -35.81 77.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.363 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.478 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 19.0 t -73.52 -35.38 44.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.903 0.383 . . . . 0.0 110.865 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.432 ' CD ' HD23 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -52.98 -51.36 61.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.816 178.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.501 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -56.15 -30.33 62.02 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.794 179.693 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.501 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 11.0 m-30 -71.25 -41.71 69.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.081 0.467 . . . . 0.0 110.205 179.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.454 HD11 ' CD2' ' A' ' 515' ' ' LEU . 1.9 mt -70.8 -58.96 3.09 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.446 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -48.56 -27.75 2.97 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.048 0.451 . . . . 0.0 110.756 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -85.91 -52.14 5.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.887 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -166.48 130.49 1.62 Allowed Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.904 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.56 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 12.2 Cg_endo -55.0 160.76 7.42 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.62 2.213 . . . . 0.0 112.708 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.456 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -154.23 178.0 10.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.457 0.646 . . . . 0.0 111.718 -179.156 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.529 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 1.3 p -111.24 159.54 17.81 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.424 HG21 HD22 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -53.9 -48.09 70.49 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.539 -179.929 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.475 ' HG2' ' CD2' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -56.98 -53.45 57.88 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.251 179.555 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -62.65 -33.47 75.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.727 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.456 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 1.3 tt -70.53 -41.65 72.29 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 121.093 0.473 . . . . 0.0 111.418 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.441 ' CD2' ' CD1' ' B' ' 590' ' ' LEU . 2.4 pp -84.19 -37.3 22.03 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.241 -179.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 471' ' ' LYS . 0.1 OUTLIER -52.07 -40.45 61.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.749 0.309 . . . . 0.0 111.219 -179.435 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.444 ' HE2' ' CE2' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -61.97 -41.68 98.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.138 -179.842 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.431 ' CD2' HG23 ' A' ' 454' ' ' VAL . 13.3 m-85 . . . . . 0 N--CA 1.45 -0.449 0 CA-C-O 121.507 0.67 . . . . 0.0 110.464 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.449 -0.482 0 CA-C-O 120.997 0.427 . . . . 0.0 111.337 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.92 158.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.582 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 12.2 p -62.0 -25.03 67.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.971 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.435 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 18.6 mt-10 -89.0 -51.15 5.75 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.354 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -42.93 96.13 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.237 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 47.9 m -49.55 -37.69 28.14 Favored 'General case' 0 CA--C 1.522 -0.12 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 179.082 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 2.7 t -71.19 -46.75 64.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.065 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.79 -25.83 43.15 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.567 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.498 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 9.1 p -101.75 -14.48 8.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.541 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 489' ' ' THR . 0.1 OUTLIER -91.41 -35.74 14.2 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.968 0.414 . . . . 0.0 110.543 179.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.445 ' HB1' ' CD1' ' B' ' 596' ' ' ILE . . . -56.44 -37.01 69.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.092 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.498 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.38 -41.49 80.5 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.768 -179.473 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.483 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 10.2 mt -77.35 -39.37 27.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.094 -179.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.471 ' HB3' ' CD1' ' B' ' 597' ' ' LEU . 1.4 mm? -42.73 -59.26 2.0 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.516 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -60.04 -30.89 69.49 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -178.798 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.404 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 0.4 OUTLIER -56.52 -23.76 41.88 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.432 HD23 ' CD ' ' A' ' 460' ' ' ARG . 55.9 mt -61.43 -47.49 85.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.756 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.559 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 58.78 59.41 5.6 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.598 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.559 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 77.3 Cg_endo -101.22 -159.32 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.356 0 C-N-CA 123.996 3.131 . . . . 0.0 111.555 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.77 139.87 52.5 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.724 178.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -79.64 133.94 36.42 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.411 0.624 . . . . 0.0 111.592 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 19.2 mtmt -156.3 159.86 39.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.569 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -105.17 111.83 24.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.965 0.412 . . . . 0.0 111.656 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.473 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.79 110.92 22.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.976 178.995 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 58.73 42.87 19.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.818 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 74.58 12.76 3.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.353 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.22 129.25 56.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.681 0.276 . . . . 0.0 110.94 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 2.9 tpt -62.13 108.57 1.09 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.013 0.435 . . . . 0.0 110.643 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.529 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 10.8 m170 -122.64 126.98 48.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.137 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.489 ' CE2' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.08 123.75 48.5 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.902 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.56 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -178.94 169.51 1.57 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.158 0.504 . . . . 0.0 112.062 -178.598 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.469 ' N ' HD21 ' A' ' 515' ' ' LEU . 1.4 pt? -116.07 169.15 9.48 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.332 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.403 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -136.48 106.67 6.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.996 0.427 . . . . 0.0 111.429 179.706 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.151 179.992 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p30 . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.722 0.296 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -52.9 -45.7 67.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.017 0.437 . . . . 0.0 111.25 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.434 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 2.2 p-80 -80.03 -23.43 41.44 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.077 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.548 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 27.3 tp -68.05 -38.85 82.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.801 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.4 mt -85.88 -29.64 6.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.612 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.76 -43.23 80.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.786 -179.455 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -71.35 -18.16 62.39 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.081 0.467 . . . . 0.0 110.196 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -63.03 -31.67 72.86 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.469 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . 0.429 ' HG3' ' O ' ' B' ' 592' ' ' TYR . 1.0 OUTLIER -76.95 -49.35 15.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.776 -179.364 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.543 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.3 pp -54.8 -26.54 17.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.155 0.502 . . . . 0.0 110.83 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.64 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 14.8 tp -69.0 -83.36 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.92 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.64 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m . . . . . 0 N--CA 1.438 -1.027 0 CA-C-N 114.656 -1.157 . . . . 0.0 110.707 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.42 HG21 ' CD2' ' A' ' 477' ' ' PHE . 2.0 t . . . . . 0 CA--C 1.517 -0.296 0 CA-C-O 121.019 0.437 . . . . 0.0 110.905 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 27.5 p -131.79 172.18 12.61 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.586 0.707 . . . . 0.0 112.575 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 17.0 mt-10 -69.04 -54.82 13.07 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.475 -1.239 . . . . 0.0 110.05 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.04 -27.07 7.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.46 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.43 ' O ' ' CD1' ' A' ' 462' ' ' TYR . . . -75.91 -37.92 58.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.752 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.428 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 6.6 t -74.57 -40.81 48.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.863 0.364 . . . . 0.0 111.428 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.533 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 2.4 mmm-85 -54.43 -39.53 67.46 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.232 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -71.01 -26.66 63.22 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.761 179.48 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.43 ' CD1' ' O ' ' A' ' 458' ' ' ALA . 15.6 m-30 -67.59 -36.96 81.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.132 0.491 . . . . 0.0 109.918 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.511 ' CD1' ' HB3' ' A' ' 500' ' ' LEU . 0.6 OUTLIER -74.84 -58.53 3.23 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.082 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.42 -28.26 2.04 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-O 121.15 0.5 . . . . 0.0 110.398 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 37.7 mtt85 -85.36 -48.58 8.9 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.561 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.48 130.21 0.54 Allowed Pre-proline 0 CA--C 1.532 0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.984 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.554 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 11.2 Cg_endo -53.65 157.18 10.25 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.753 2.302 . . . . 0.0 112.576 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.473 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.95 172.24 16.0 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.405 0.622 . . . . 0.0 111.694 -179.415 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.53 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 35.1 p -103.73 160.69 14.56 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 177.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.416 ' O ' ' HG ' ' A' ' 474' ' ' LEU . 0.0 OUTLIER -54.52 -43.72 72.14 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.057 -0.657 . . . . 0.0 110.487 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.56 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -61.24 -59.12 5.8 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.797 178.871 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -56.85 -20.44 22.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.581 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.473 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 1.6 tt -87.87 -42.4 12.55 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.015 0.436 . . . . 0.0 111.446 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.49 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 2.0 pp -84.38 -48.04 10.08 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.144 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 32.6 mmtt -48.83 -29.84 5.08 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -179.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.426 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -68.52 -41.68 79.61 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.932 -179.841 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.426 ' CE2' ' HE2' ' A' ' 476' ' ' LYS . 11.5 m-85 . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 111.021 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.402 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 1.6 tp . . . . . 0 N--CA 1.452 -0.334 0 CA-C-O 121.011 0.434 . . . . 0.0 111.088 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.33 151.29 0.37 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.66 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 m -59.96 -24.71 64.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.454 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.434 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 4.3 mt-10 -91.35 -45.78 8.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.553 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -63.46 -41.32 98.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.077 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.488 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 85.6 m -50.32 -30.28 11.69 Favored 'General case' 0 C--N 1.334 -0.087 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 5.0 t -83.62 -39.85 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.989 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -61.04 -31.17 70.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.907 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.501 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 4.0 p -97.1 -12.49 8.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.861 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.496 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 0.3 OUTLIER -91.06 -40.9 11.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.176 0.512 . . . . 0.0 110.024 179.409 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.504 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -50.28 -36.64 32.35 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.257 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.9 OUTLIER -66.9 -42.87 84.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.297 -179.607 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.511 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 7.1 mt -77.74 -43.79 29.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.468 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.496 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.0 OUTLIER -36.05 -57.67 0.69 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.729 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.477 ' N ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -62.52 -22.77 66.55 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.29 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.474 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 1.4 mmp_? -60.14 -19.88 55.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.937 0.399 . . . . 0.0 110.69 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.511 ' HB3' ' CD1' ' A' ' 463' ' ' LEU . 16.4 mt -64.46 -47.92 77.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.044 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.574 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 56.81 59.07 8.21 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.403 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.574 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 73.9 Cg_endo -101.09 -160.22 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 124.02 3.147 . . . . 0.0 111.669 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.76 141.03 49.83 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.681 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.53 134.82 36.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.291 0.567 . . . . 0.0 111.591 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 10.9 mtmt -156.08 160.2 39.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.608 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -103.41 109.96 21.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.977 0.418 . . . . 0.0 111.699 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.499 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.73 110.81 22.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.869 178.896 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 58.35 44.53 18.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.975 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.5 t0 72.83 11.8 5.31 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.478 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 507' ' ' ILE . 1.8 tpmt? -116.08 128.81 55.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.606 0.241 . . . . 0.0 110.701 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 511' ' ' MET . . . . . 0.414 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -62.86 108.63 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.953 0.406 . . . . 0.0 110.581 180.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.53 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 10.4 m170 -122.56 129.47 51.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.825 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.546 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -108.91 123.47 49.13 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.775 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.554 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -177.89 169.34 2.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.059 0.457 . . . . 0.0 111.959 -178.57 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.482 ' N ' HD21 ' A' ' 515' ' ' LEU . 1.5 pt? -114.12 169.13 9.25 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.468 179.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.4 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -137.57 106.71 6.02 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.052 0.453 . . . . 0.0 111.499 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.171 -179.99 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.5 p30 . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.745 0.307 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -51.76 -47.15 64.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.033 0.444 . . . . 0.0 110.976 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.425 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 2.3 p-80 -80.13 -25.06 40.07 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.04 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.536 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 21.5 tp -58.94 -29.96 67.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.839 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 80.5 mt -85.86 -29.7 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.229 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.574 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.58 -38.13 88.64 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.799 -179.291 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.574 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -78.98 -17.9 54.6 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.153 0.502 . . . . 0.0 110.106 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -61.8 -31.27 71.48 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.817 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 8.3 pt-20 -82.49 -47.13 12.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.406 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.555 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.1 pp -51.76 -26.74 7.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.018 0.437 . . . . 0.0 111.219 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.66 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 14.4 tp -68.47 -83.33 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.58 0.705 . . . . 0.0 111.516 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.66 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m . . . . . 0 N--CA 1.437 -1.115 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.43 -178.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.436 HG22 ' CD2' ' A' ' 477' ' ' PHE . 4.6 t . . . . . 0 CA--C 1.517 -0.324 0 CA-C-O 120.978 0.418 . . . . 0.0 110.707 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 455' ' ' THR . . . . . 0.433 ' O ' HG22 ' A' ' 459' ' ' VAL . 30.6 p -131.58 159.65 37.6 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.552 0.692 . . . . 0.0 112.644 -179.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 19.8 mt-10 -54.73 -54.69 38.58 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.505 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.34 -28.35 42.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.924 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.416 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -80.22 -33.14 38.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.968 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.439 HG22 HG21 ' A' ' 496' ' ' ILE . 2.8 t -75.8 -36.04 32.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.768 0.318 . . . . 0.0 111.472 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 2.3 mmm-85 -57.46 -38.62 74.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.919 0.39 . . . . 0.0 110.088 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.458 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -70.31 -29.12 65.76 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.562 179.298 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.458 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 7.1 m-30 -64.83 -38.78 92.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.14 0.495 . . . . 0.0 109.813 179.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.504 ' HB2' HD23 ' A' ' 515' ' ' LEU . 0.3 OUTLIER -73.97 -58.27 3.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.193 -179.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.89 -27.8 2.31 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 121.143 0.497 . . . . 0.0 110.478 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -87.57 -49.73 6.98 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.792 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.4 ' CE ' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -169.28 125.98 0.79 Allowed Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.138 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.592 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 9.2 Cg_endo -52.14 158.42 5.16 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.707 2.271 . . . . 0.0 112.878 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.503 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -151.13 168.46 24.58 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-O 121.451 0.643 . . . . 0.0 111.968 -179.528 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.506 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 2.1 p -100.9 176.37 5.3 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 176.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.419 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -71.04 -41.51 70.71 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 119.781 -0.767 . . . . 0.0 110.616 179.655 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.413 ' O ' ' CD ' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -64.62 -49.69 70.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.669 178.659 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . 0.523 ' HA ' ' HD3' ' A' ' 475' ' ' LYS . 11.5 t70 -59.13 -40.1 84.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.247 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.503 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 1.0 OUTLIER -62.15 -41.27 98.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.096 0.474 . . . . 0.0 111.137 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.521 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 1.0 OUTLIER -84.46 -26.03 28.49 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.314 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.523 ' HD3' ' HA ' ' A' ' 472' ' ' ASP . 0.0 OUTLIER -54.85 -36.51 65.13 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.577 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.48 ' CE ' ' HA ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -81.38 -43.75 18.55 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.063 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.436 ' CD2' HG22 ' A' ' 454' ' ' VAL . 11.5 m-85 . . . . . 0 N--CA 1.451 -0.392 0 CA-C-O 121.288 0.566 . . . . 0.0 109.857 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 3.3 mp . . . . . 0 N--CA 1.446 -0.657 0 CA-C-O 121.004 0.431 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -39.53 155.06 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.636 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 p -62.7 -20.39 64.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.463 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 4.0 mt-10 -95.48 -39.95 9.72 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.748 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . 0.426 ' HA ' ' HB3' ' A' ' 491' ' ' ASN . 14.0 mt-30 -69.26 -43.76 73.29 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.568 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 90.1 m -49.18 -28.99 4.93 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 121.271 0.558 . . . . 0.0 109.839 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . 0.43 ' CG1' ' HG ' ' B' ' 593' ' ' LEU . 17.4 t -84.28 -39.98 15.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.631 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . 0.426 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 9.4 t30 -60.99 -29.91 69.97 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.975 178.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.52 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.6 p -97.48 -13.14 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.938 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.521 ' CD2' ' HB3' ' A' ' 474' ' ' LEU . 5.6 tp -90.95 -43.76 9.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.129 0.49 . . . . 0.0 110.107 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.519 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -49.29 -33.87 14.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.543 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.9 OUTLIER -69.09 -43.19 75.0 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.877 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.528 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 6.4 mt -78.93 -32.43 15.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -178.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.513 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.1 OUTLIER -46.05 -57.72 4.21 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.679 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.457 ' N ' HD11 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.96 -29.19 68.25 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -178.26 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.49 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 4.0 mmm180 -58.29 -22.08 51.46 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.91 0.386 . . . . 0.0 110.681 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.448 ' CD1' HD12 ' A' ' 463' ' ' LEU . 65.2 mt -58.74 -47.62 83.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.529 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.609 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.1 t-20 56.48 57.45 9.02 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.507 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.609 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.9 Cg_endo -101.74 -163.26 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.44 0 C-N-CA 124.175 3.25 . . . . 0.0 111.843 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . 0.406 ' O ' ' CD ' ' A' ' 505' ' ' LYS . 0.1 OUTLIER -116.39 145.07 43.52 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.038 178.51 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -83.24 132.91 35.02 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.404 0.621 . . . . 0.0 111.985 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.406 ' CD ' ' O ' ' A' ' 503' ' ' GLU . 0.0 OUTLIER -150.32 159.67 44.29 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.455 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 506' ' ' MET . . . . . 0.438 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -105.1 112.17 25.21 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.605 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.445 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.7 OUTLIER -90.89 110.92 22.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.025 179.237 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.7 t30 58.85 41.99 20.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.764 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.3 t70 74.37 14.89 3.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.252 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 506' ' ' MET . 0.0 OUTLIER -116.26 131.61 56.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 110.908 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 3.7 tpt -62.54 108.4 1.13 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.93 0.395 . . . . 0.0 110.687 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.506 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 10.4 m170 -122.84 128.81 50.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.408 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.502 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.73 123.36 48.02 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.701 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.592 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.6 OUTLIER 179.11 169.13 0.97 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.107 0.48 . . . . 0.0 111.985 -178.857 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.504 HD23 ' HB2' ' A' ' 463' ' ' LEU . 1.6 pt? -114.04 169.17 9.21 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.382 178.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.42 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -142.42 106.52 4.74 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.083 0.468 . . . . 0.0 111.382 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.847 179.911 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.307 0 CA-C-O 120.737 0.303 . . . . 0.0 111.763 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -53.33 -55.21 26.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.011 0.434 . . . . 0.0 111.73 -179.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.664 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.2 p-80 -77.08 -21.63 54.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.334 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.541 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 24.3 tp -60.6 -29.52 69.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.544 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . 0.406 HD13 HG23 ' B' ' 591' ' ' ILE . 79.0 mt -85.75 -34.32 8.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.664 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.78 -40.89 68.93 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.359 -0.537 . . . . 0.0 112.161 -178.901 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.65 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -66.5 -18.54 65.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.103 0.478 . . . . 0.0 110.246 -179.762 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -63.4 -30.87 71.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.597 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.1 -47.97 17.08 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.126 -179.115 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.569 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.1 pp -52.33 -26.59 9.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.214 0.531 . . . . 0.0 110.89 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.663 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.1 tp -69.61 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.483 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.663 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 34.4 m . . . . . 0 N--CA 1.439 -1.014 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.65 -178.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.45 HG22 ' CD2' ' A' ' 477' ' ' PHE . 79.0 t . . . . . 0 CA--C 1.515 -0.38 0 CA-C-O 120.902 0.382 . . . . 0.0 110.555 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 455' ' ' THR . . . . . 0.407 ' O ' HG21 ' A' ' 459' ' ' VAL . 23.4 p -131.52 157.78 42.66 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 121.556 0.693 . . . . 0.0 112.481 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.532 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 22.9 mt-10 -51.38 -53.36 37.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.475 -1.239 . . . . 0.0 110.941 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.71 -31.46 72.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.56 -179.151 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.437 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -71.37 -36.69 71.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.396 -179.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.489 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 16.4 t -72.31 -25.7 23.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.121 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.532 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.2 OUTLIER -63.11 -51.04 68.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.109 0.48 . . . . 0.0 109.814 178.769 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.471 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -54.93 -28.09 48.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 179.394 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.489 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 12.9 m-30 -68.81 -45.31 71.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.148 179.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.528 ' CB ' HD13 ' A' ' 515' ' ' LEU . 0.7 OUTLIER -68.47 -57.4 5.88 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.238 179.704 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -48.84 -24.51 1.47 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.789 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.553 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 24.4 ttp180 -93.35 -31.33 14.7 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.531 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.553 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER 169.89 162.7 0.2 Allowed Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.662 -179.588 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.718 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 73.9 Cg_endo -72.0 163.31 39.2 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.341 2.027 . . . . 0.0 113.34 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.475 ' CE ' ' CD1' ' A' ' 513' ' ' PHE . 0.0 OUTLIER -152.15 152.64 32.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.383 -178.794 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.422 HG23 ' CE1' ' A' ' 512' ' ' HIS . 0.6 OUTLIER -95.9 162.4 13.59 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.021 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.513 HG21 HD22 ' B' ' 593' ' ' LEU . 1.8 p -65.3 -34.11 77.57 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.853 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.541 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -73.63 -50.91 18.73 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.35 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -59.73 -19.68 51.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.228 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.515 HD13 HD12 ' A' ' 497' ' ' LEU . 0.4 OUTLIER -75.24 -41.25 57.91 Favored 'General case' 0 C--O 1.23 0.051 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.133 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.436 ' CD2' ' CD1' ' B' ' 590' ' ' LEU . 1.3 pp -84.33 -46.53 11.66 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.541 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 37.4 mmtt -46.69 -29.23 1.78 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.773 0.32 . . . . 0.0 111.479 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.461 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -78.06 -41.24 36.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.642 179.547 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.461 ' CE2' ' HE2' ' A' ' 476' ' ' LYS . 16.5 m-85 . . . . . 0 N--CA 1.452 -0.339 0 CA-C-O 121.298 0.57 . . . . 0.0 110.073 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.4 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 4.3 mp . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 120.961 0.41 . . . . 0.0 111.279 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.26 156.72 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.729 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -24.13 67.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.09 178.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.411 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 10.7 mt-10 -88.84 -48.35 7.54 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.577 179.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -60.42 -43.25 96.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.997 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.415 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 92.7 m -49.43 -29.36 6.33 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 121.111 0.481 . . . . 0.0 109.785 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . 0.452 ' HA ' ' HB3' ' A' ' 493' ' ' LEU . 8.2 t -83.55 -40.97 16.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.937 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -60.96 -29.78 69.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.98 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.436 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 6.8 p -99.03 -6.97 9.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.823 179.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.453 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 9.6 tp -94.88 -34.58 12.38 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.003 0.43 . . . . 0.0 110.483 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.454 ' HB3' ' CD1' ' B' ' 596' ' ' ILE . . . -61.29 -37.02 81.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.109 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.436 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.5 OUTLIER -66.45 -45.27 80.34 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.849 -179.483 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.498 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 10.9 mt -73.93 -40.15 52.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.79 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.515 HD12 HD13 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -38.82 -63.04 0.55 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.891 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.496 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.5 -27.99 66.65 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -58.81 -21.06 55.44 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.083 0.468 . . . . 0.0 110.992 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.493 ' HB3' ' CD1' ' A' ' 463' ' ' LEU . 84.5 mt -61.67 -47.76 83.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.503 -179.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.586 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.9 t-20 60.95 57.67 3.59 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.04 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.586 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 58.5 Cg_endo -101.22 -160.63 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 124.291 3.327 . . . . 0.0 111.771 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.95 138.21 54.5 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.782 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.68 133.61 36.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.388 0.613 . . . . 0.0 111.719 -178.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -156.33 146.99 21.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.81 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 506' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -89.22 111.26 22.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.94 0.4 . . . . 0.0 111.362 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.462 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.78 110.93 22.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.172 179.299 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 1.5 t30 60.06 41.85 16.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.906 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 3.9 t0 74.22 13.82 3.87 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.223 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.405 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.08 130.64 56.9 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.838 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.51 108.7 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 0.0 110.718 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.451 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 19.4 m80 -122.58 155.75 35.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.673 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.542 ' CE1' HD23 ' B' ' 597' ' ' LEU . 5.3 p90 -134.29 123.69 24.62 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.757 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.718 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER 179.77 169.43 1.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.391 0.615 . . . . 0.0 112.03 -178.99 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.552 ' CD2' ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -118.54 168.86 10.28 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.425 178.454 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.503 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -135.07 106.02 6.61 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.167 0.508 . . . . 0.0 111.165 179.369 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.023 -179.971 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.277 0 CA-C-O 120.739 0.304 . . . . 0.0 111.784 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -52.72 -55.16 24.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.091 0.472 . . . . 0.0 111.56 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -79.7 -21.89 44.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.181 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.567 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 28.2 tp -52.0 -39.81 60.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.043 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 54.5 mt -86.06 -29.71 6.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.134 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.559 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.57 -39.61 84.9 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.45 -179.781 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.614 ' O ' HG13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -78.52 -18.0 55.38 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.156 0.503 . . . . 0.0 109.92 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . 0.617 ' HA ' HG22 ' A' ' 470' ' ' THR . 0.4 OUTLIER -63.43 -30.76 71.84 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.974 179.709 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 6.5 pt-20 -80.73 -47.41 14.0 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.614 HG13 ' O ' ' B' ' 593' ' ' LEU . 1.5 pp -50.15 -26.54 3.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.138 0.494 . . . . 0.0 110.991 179.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.621 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 11.9 tp -64.63 -83.77 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.307 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.621 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.8 m . . . . . 0 N--CA 1.436 -1.147 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.188 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.451 HG22 ' CD2' ' A' ' 477' ' ' PHE . 7.5 t . . . . . 0 CA--C 1.514 -0.418 0 CA-C-O 121.019 0.438 . . . . 0.0 110.636 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 23.2 p -132.02 164.29 26.52 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.539 0.685 . . . . 0.0 112.192 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.53 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 18.6 mt-10 -57.33 -53.47 57.79 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.506 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.99 -29.22 63.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.07 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.406 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -74.6 -35.06 62.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.644 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.474 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 14.2 t -76.02 -28.36 18.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 120.859 -0.337 . . . . 0.0 111.511 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.53 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -62.73 -50.82 69.57 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.98 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.444 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -55.43 -27.04 45.46 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.356 179.053 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.507 ' O ' ' O ' ' A' ' 466' ' ' LYS . 11.4 m-30 -68.38 -44.44 75.14 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.54 ' CB ' HD13 ' A' ' 515' ' ' LEU . 0.4 OUTLIER -70.58 -54.36 12.36 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.099 179.318 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -48.09 -24.65 1.17 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.673 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.603 ' O ' ' HG2' ' A' ' 466' ' ' LYS . 3.5 ptp85 -97.04 -47.84 5.63 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.336 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.661 ' HD3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -165.77 166.79 9.64 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 122.316 0.247 . . . . 0.0 110.708 179.905 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.661 ' HD2' ' HD3' ' A' ' 466' ' ' LYS . 97.0 Cg_endo -77.15 162.86 31.17 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.276 1.984 . . . . 0.0 113.551 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.407 ' HB2' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -156.14 151.16 26.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.168 -178.74 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.485 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 10.9 p -99.11 175.06 6.03 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.617 HG22 ' HA ' ' B' ' 594' ' ' GLU . 0.6 OUTLIER -71.31 -31.52 67.53 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.333 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.574 ' HD2' ' H ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -77.0 -53.52 7.72 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.325 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -57.89 -19.94 33.2 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.757 178.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.471 ' CD1' ' CD1' ' A' ' 497' ' ' LEU . 6.8 mt -77.27 -40.92 42.94 Favored 'General case' 0 C--O 1.23 0.054 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 471' ' ' LYS . 1.6 pp -84.22 -47.37 10.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 18.0 mmtp -46.85 -28.33 1.53 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.698 0.285 . . . . 0.0 111.484 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.492 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -79.56 -41.03 28.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.653 179.545 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.492 ' CE2' ' HE2' ' A' ' 476' ' ' LYS . 16.8 m-85 . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 121.529 0.681 . . . . 0.0 110.053 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 1.5 mp . . . . . 0 N--CA 1.451 -0.395 0 CA-C-O 120.919 0.39 . . . . 0.0 111.422 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.93 154.23 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.82 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 74.2 m -61.15 -26.41 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.139 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -84.61 -53.28 5.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.443 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.66 -40.48 87.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.023 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 44.2 m -51.43 -31.06 21.62 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . 0.464 ' HA ' ' HB3' ' A' ' 493' ' ' LEU . 2.5 t -78.86 -42.59 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.309 179.321 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.51 -34.05 72.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.897 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.508 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.3 p -93.7 -10.46 9.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.75 179.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.562 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 21.2 tp -90.24 -44.39 9.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.092 0.473 . . . . 0.0 110.554 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.477 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -51.61 -33.9 35.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.69 -179.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.74 -41.9 78.34 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.216 -179.093 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.511 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 10.5 mt -79.13 -29.95 14.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.562 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.3 OUTLIER -47.63 -58.35 4.38 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.489 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.516 ' H ' ' HD2' ' A' ' 498' ' ' LYS . 0.0 OUTLIER -59.42 -28.05 66.59 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -177.856 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.502 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.5 mmm180 -60.38 -20.84 61.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.057 0.456 . . . . 0.0 110.19 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.54 ' HB3' HD12 ' A' ' 463' ' ' LEU . 77.4 mt -59.59 -47.61 84.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.037 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.621 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 28.0 t-20 55.36 54.5 9.71 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.164 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.621 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 69.7 Cg_endo -101.25 -160.15 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 124.071 3.181 . . . . 0.0 111.596 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.19 140.44 50.19 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.834 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.7 133.57 36.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.316 0.579 . . . . 0.0 111.477 -178.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -156.36 132.11 9.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.989 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.18 108.86 13.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.876 0.369 . . . . 0.0 111.396 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.448 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.61 110.8 22.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.938 179.047 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 66.2 t30 59.64 43.9 15.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.857 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.6 t0 72.4 13.29 5.54 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.279 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.423 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.08 128.44 55.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.777 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.98 108.65 0.9 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.041 0.448 . . . . 0.0 110.519 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.518 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 24.7 m80 -122.8 132.82 54.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.211 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.485 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.0 OUTLIER -108.51 123.77 49.41 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.788 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.637 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER -171.82 169.69 5.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.556 0.693 . . . . 0.0 112.762 -178.735 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.553 ' CD2' ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -129.19 168.92 15.46 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.341 178.401 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.472 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -131.44 105.78 7.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.064 0.459 . . . . 0.0 110.9 179.106 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.918 179.999 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 120.813 0.339 . . . . 0.0 111.566 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -53.45 -55.16 27.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.077 0.465 . . . . 0.0 111.561 -179.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -80.01 -21.81 43.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.235 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.537 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 39.1 tp -48.63 -29.54 4.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.299 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 79.1 mt -85.61 -29.77 6.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.216 -179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.574 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.48 -52.13 65.77 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.15 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.574 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -66.51 -17.94 65.09 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.497 -179.612 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . 0.458 ' HA ' HG23 ' A' ' 470' ' ' THR . 1.0 OUTLIER -62.28 -30.87 71.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.968 -179.682 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . 0.403 ' CG ' ' O ' ' B' ' 592' ' ' TYR . 1.6 pt-20 -82.52 -43.73 16.79 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.566 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.3 pp -53.86 -26.5 14.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.097 0.475 . . . . 0.0 111.172 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.652 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.6 tp -71.1 -82.65 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.557 0.694 . . . . 0.0 112.041 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.652 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.4 m . . . . . 0 N--CA 1.438 -1.073 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.627 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.479 HG23 ' CG ' ' A' ' 477' ' ' PHE . 59.3 t . . . . . 0 CA--C 1.516 -0.36 0 CA-C-O 120.844 0.355 . . . . 0.0 110.648 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 455' ' ' THR . . . . . 0.413 ' O ' HG23 ' A' ' 459' ' ' VAL . 25.4 p -131.65 163.36 28.28 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.642 0.734 . . . . 0.0 112.503 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.53 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 22.3 mt-10 -58.56 -52.57 65.1 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.51 -1.223 . . . . 0.0 110.933 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.03 -27.49 68.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.581 -178.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.448 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -70.07 -58.18 4.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.738 0.304 . . . . 0.0 111.62 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.542 ' O ' ' HG ' ' A' ' 463' ' ' LEU . 16.9 t -48.17 -31.72 3.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.946 0.403 . . . . 0.0 110.9 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.8 OUTLIER -54.69 -47.99 72.98 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.259 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -63.35 -27.88 69.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.507 179.452 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.512 ' CE2' ' CE2' ' A' ' 477' ' ' PHE . 8.2 m-30 -68.78 -42.9 76.76 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.289 0.566 . . . . 0.0 109.649 178.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 459' ' ' VAL . 3.7 mt -70.35 -60.29 2.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.964 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -49.44 -24.43 1.99 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.065 -179.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -92.93 -46.04 7.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.508 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.478 ' HD2' ' HD2' ' A' ' 467' ' ' PRO . 1.4 mmmt -165.2 128.8 1.67 Allowed Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.005 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.611 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 18.0 Cg_endo -56.17 146.09 72.85 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.358 2.039 . . . . 0.0 112.716 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.491 ' HE1' ' O ' ' A' ' 513' ' ' PHE . 0.0 OUTLIER -132.78 178.23 7.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.278 -179.276 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.508 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 10.1 p -124.16 160.71 27.24 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.094 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.507 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.7 OUTLIER -58.22 -30.84 66.82 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.192 -0.603 . . . . 0.0 111.251 -179.174 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.477 ' HA ' ' CD1' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -76.53 -50.84 12.93 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.823 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . 0.417 ' HA ' ' CD ' ' A' ' 475' ' ' LYS . 11.9 t70 -64.79 -31.04 72.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.86 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.523 ' O ' ' HE3' ' A' ' 476' ' ' LYS . 0.5 OUTLIER -60.13 -42.36 94.62 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.164 0.507 . . . . 0.0 110.985 -179.558 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.467 ' CD2' ' CD1' ' B' ' 590' ' ' LEU . 2.9 pp -85.24 -25.03 27.53 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.555 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.472 ' HD2' ' O ' ' A' ' 471' ' ' LYS . 4.1 mttt -46.05 -36.32 5.62 Favored 'General case' 0 N--CA 1.461 0.109 0 N-CA-C 111.628 0.232 . . . . 0.0 111.628 -178.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.523 ' HE3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -93.43 -43.23 8.85 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.135 179.573 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.512 ' CE2' ' CE2' ' A' ' 462' ' ' TYR . 3.0 m-85 . . . . . 0 N--CA 1.45 -0.44 0 CA-C-O 121.381 0.61 . . . . 0.0 110.158 179.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.417 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.448 -0.562 0 CA-C-O 121.107 0.479 . . . . 0.0 111.407 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.51 161.09 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.496 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 98.9 p -60.89 -24.98 66.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.021 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -91.02 -43.51 9.89 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.349 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -64.08 -41.24 97.39 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.918 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 91.8 m -51.75 -27.7 12.9 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.714 178.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 6.6 t -84.94 -40.37 14.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.813 178.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -61.09 -32.0 71.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.911 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.511 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.7 p -94.01 -11.15 9.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.752 179.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.471 ' CD1' ' CD2' ' A' ' 497' ' ' LEU . 21.8 tp -89.85 -43.04 10.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.216 0.531 . . . . 0.0 110.204 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.464 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -51.97 -33.54 38.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.658 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.23 -42.88 79.11 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.891 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.53 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 9.9 mt -72.86 -45.28 56.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -178.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.507 ' HG ' ' CG2' ' A' ' 470' ' ' THR . 0.7 OUTLIER -37.38 -64.01 0.4 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.6 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.501 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.61 -27.06 65.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.991 0.424 . . . . 0.0 111.261 -179.282 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.71 -26.5 68.7 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.547 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.44 HD22 ' HD2' ' A' ' 460' ' ' ARG . 67.3 mt -60.36 -47.37 86.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.918 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.553 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 59.12 59.69 5.13 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.732 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.553 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 91.7 Cg_endo -101.19 -159.25 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.326 0 C-N-CA 124.04 3.16 . . . . 0.0 111.317 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.39 141.53 48.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.738 178.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -79.47 134.23 36.53 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.321 0.581 . . . . 0.0 111.292 -179.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -156.12 157.95 36.87 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.857 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 506' ' ' MET . . . . . 0.432 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.8 OUTLIER -105.19 109.94 22.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.93 0.395 . . . . 0.0 111.532 -179.757 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.467 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.72 110.79 22.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.867 178.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 59.51 44.41 14.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.739 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 6.5 t0 71.16 13.83 6.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.257 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.452 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.15 134.69 54.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.784 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.78 108.74 2.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.937 0.399 . . . . 0.0 110.88 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.508 ' CE1' ' CG2' ' A' ' 469' ' ' THR . 25.6 m80 -123.05 130.7 53.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.093 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.492 ' CD2' ' CD2' ' B' ' 597' ' ' LEU . 0.0 OUTLIER -105.0 125.44 50.98 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.092 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.611 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER -175.29 169.33 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.78 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.545 HD22 ' N ' ' A' ' 515' ' ' LEU . 1.2 pt? -122.74 169.14 11.38 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.062 178.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.79 106.75 8.31 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.434 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.044 -179.993 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p30 . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.814 0.34 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -57.51 -40.8 79.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.899 0.381 . . . . 0.0 111.413 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.425 ' CE1' ' HG3' ' A' ' 487' ' ' GLU . 2.1 p-80 -80.32 -21.87 42.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.724 -179.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.541 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 16.6 tp -53.5 -31.05 44.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.957 0.408 . . . . 0.0 110.72 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.7 mt -85.76 -29.59 6.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.892 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.578 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.42 -38.74 92.1 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.809 -179.441 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.578 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -78.39 -18.0 55.65 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.191 0.52 . . . . 0.0 109.988 -179.887 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . 0.475 ' HA ' HG22 ' A' ' 470' ' ' THR . 1.1 pt-20 -62.37 -30.75 71.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.844 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 7.5 pt-20 -82.2 -48.49 11.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.316 -179.101 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.511 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.3 pp -52.39 -26.8 9.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.22 0.533 . . . . 0.0 111.211 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.632 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.8 tp -60.87 -84.86 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.343 -0.844 . . . . 0.0 113.027 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.632 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 34.8 m . . . . . 0 N--CA 1.436 -1.156 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.679 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.452 HG22 ' CD2' ' A' ' 477' ' ' PHE . 93.1 t . . . . . 0 CA--C 1.516 -0.349 0 CA-C-O 120.878 0.37 . . . . 0.0 110.564 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 455' ' ' THR . . . . . 0.406 ' CA ' HD12 ' A' ' 496' ' ' ILE . 23.6 p -131.49 163.66 27.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.634 0.73 . . . . 0.0 112.361 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.501 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 21.7 mt-10 -57.99 -53.08 62.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.67 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.49 -28.09 68.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.0 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -67.51 -58.07 5.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.828 0.346 . . . . 0.0 111.36 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.508 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 21.2 t -50.58 -28.83 6.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.581 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.9 OUTLIER -58.5 -45.49 88.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.978 0.418 . . . . 0.0 110.434 179.036 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -60.87 -25.38 66.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.929 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.508 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 8.8 m-30 -77.83 -39.74 42.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.832 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.475 HD13 ' CD1' ' A' ' 500' ' ' LEU . 0.9 OUTLIER -70.08 -61.4 1.79 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.233 179.914 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -48.37 -27.27 2.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.093 0.473 . . . . 0.0 110.563 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 45.1 ttp180 -87.1 -50.32 6.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.907 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.417 ' HD2' ' HD2' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -167.46 128.28 1.18 Allowed Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.612 -179.839 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.649 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 9.0 Cg_endo -48.78 169.7 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.234 1.956 . . . . 0.0 112.502 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.431 ' HE2' ' CD1' ' A' ' 513' ' ' PHE . 0.0 OUTLIER -156.42 -178.55 7.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.601 0.715 . . . . 0.0 111.88 -178.801 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.458 HG23 ' CE1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -119.84 170.61 9.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.59 -1.186 . . . . 0.0 107.818 177.744 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.475 HG22 ' HA ' ' B' ' 594' ' ' GLU . 0.6 OUTLIER -71.15 -32.86 69.47 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.074 -0.65 . . . . 0.0 110.612 179.682 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.56 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -76.86 -46.66 23.79 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.461 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -64.25 -20.53 66.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.534 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 476' ' ' LYS . 4.8 mt -78.39 -37.23 44.53 Favored 'General case' 0 C--N 1.334 -0.081 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.441 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 1.4 pp -82.46 -49.51 9.86 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.132 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 16.1 mmtp -46.72 -28.84 1.64 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -75.76 -43.0 48.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.921 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.452 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.5 m-85 . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.475 0.655 . . . . 0.0 110.294 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.412 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 120.953 0.406 . . . . 0.0 111.096 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.12 160.82 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.532 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -23.93 63.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.162 0.506 . . . . 0.0 109.741 178.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.425 ' HG3' ' CE1' ' B' ' 589' ' ' HIS . 10.5 tt0 -89.77 -51.4 5.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.167 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.06 -41.68 88.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.019 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 91.9 m -50.61 -30.5 13.5 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.715 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . 0.478 ' HA ' ' HB3' ' A' ' 493' ' ' LEU . 3.4 t -82.57 -40.59 16.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.184 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -60.37 -30.74 69.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.962 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.489 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 5.6 p -99.01 -6.94 9.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.835 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.518 ' HG ' HD23 ' A' ' 497' ' ' LEU . 13.8 tp -94.29 -40.79 9.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.032 0.444 . . . . 0.0 110.557 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.482 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -54.67 -38.02 66.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.442 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.489 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.59 -41.92 95.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.935 -179.286 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.501 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 13.7 mt -77.75 -48.17 24.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.518 HD23 ' HG ' ' A' ' 493' ' ' LEU . 0.0 OUTLIER -31.58 -64.05 0.16 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.487 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.511 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -60.18 -29.82 68.95 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.415 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -55.52 -23.3 25.57 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.971 0.415 . . . . 0.0 111.036 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.475 ' CD1' HD13 ' A' ' 463' ' ' LEU . 16.0 mt -63.1 -47.45 82.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.654 -179.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.552 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 60.68 59.83 3.65 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.013 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.552 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 53.1 Cg_endo -99.78 -159.24 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 123.983 3.122 . . . . 0.0 111.6 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.55 140.19 51.83 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.828 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.59 134.89 36.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.369 0.604 . . . . 0.0 111.713 -178.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -156.22 160.08 39.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.588 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 506' ' ' MET . . . . . 0.419 ' HE1' ' HA ' ' A' ' 509' ' ' ASP . 8.6 ptm -97.79 109.95 22.61 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.137 0.494 . . . . 0.0 111.589 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.536 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.3 OUTLIER -90.63 110.92 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.852 179.103 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 60.37 38.77 19.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.719 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . 0.419 ' HA ' ' HE1' ' A' ' 506' ' ' MET . 5.2 t70 77.86 10.15 2.21 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.573 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.46 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.24 134.23 55.14 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.619 0.247 . . . . 0.0 111.088 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 511' ' ' MET . . . . . 0.405 ' O ' ' CG2' ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.04 108.61 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.098 0.475 . . . . 0.0 111.004 -179.974 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.536 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 2.2 m80 -122.62 148.37 45.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.436 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.489 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -126.1 123.31 38.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.245 179.666 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.649 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -176.68 169.3 2.54 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.142 0.496 . . . . 0.0 111.945 -179.129 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.494 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.6 pt? -114.24 169.15 9.24 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.404 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.419 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -142.35 106.43 4.74 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.029 0.443 . . . . 0.0 111.378 179.683 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.826 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 120.742 0.306 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.87 -47.28 64.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.962 0.411 . . . . 0.0 111.376 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.434 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 2.1 p-80 -80.07 -21.85 42.93 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.238 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.625 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 26.1 tp -62.95 -43.61 98.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.793 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 51.3 mt -86.13 -29.55 6.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 120.813 0.34 . . . . 0.0 111.009 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.567 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -63.28 -44.97 93.55 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.643 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.625 ' CD1' ' O ' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -69.69 -19.72 63.57 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.38 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -63.13 -30.86 71.93 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.337 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.32 -44.45 62.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.495 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.479 HD11 ' HB3' ' A' ' 494' ' ' ALA . 4.8 pt -58.17 -26.64 30.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.184 0.516 . . . . 0.0 110.963 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.647 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.0 tp -72.73 -81.78 0.05 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.04 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.647 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.0 m . . . . . 0 N--CA 1.438 -1.054 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.731 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.46 ' CG2' ' CG ' ' A' ' 477' ' ' PHE . 0.9 OUTLIER . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 120.964 0.412 . . . . 0.0 110.796 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 455' ' ' THR . . . . . 0.433 ' O ' HG21 ' A' ' 459' ' ' VAL . 27.4 p -131.65 169.87 15.55 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.557 0.694 . . . . 0.0 112.654 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.514 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 20.6 mt-10 -69.13 -54.7 13.59 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.271 179.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.96 -26.76 6.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.758 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.431 ' O ' ' CD1' ' A' ' 462' ' ' TYR . . . -77.16 -35.54 55.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.85 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.471 HG21 HG21 ' A' ' 496' ' ' ILE . 4.0 t -76.1 -40.15 36.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.876 0.37 . . . . 0.0 111.392 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.6 mmm180 -53.99 -39.24 65.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.254 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.455 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -70.8 -28.83 64.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.614 179.334 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.455 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 14.2 m-30 -65.69 -36.95 85.1 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.497 ' HB2' HD23 ' A' ' 515' ' ' LEU . 0.5 OUTLIER -74.27 -55.96 5.44 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.838 179.718 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.48 -25.36 3.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.679 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.405 ' HG3' ' N ' ' A' ' 466' ' ' LYS . 24.6 ptt180 -92.99 -39.45 11.1 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.223 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -176.73 132.24 0.38 Allowed Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 120.72 0.295 . . . . 0.0 111.044 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.636 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 18.0 Cg_endo -58.06 152.47 51.48 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.752 2.301 . . . . 0.0 113.41 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.452 ' HA ' ' CD2' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -150.09 161.36 42.51 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.507 -179.505 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.461 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 11.6 p -96.62 -178.41 4.25 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.409 HG23 ' CD2' ' B' ' 593' ' ' LEU . 0.2 OUTLIER -71.06 -44.71 65.2 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.687 -0.805 . . . . 0.0 110.88 179.593 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.507 ' H ' ' CD ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -62.32 -51.88 65.88 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.995 179.284 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . 0.428 ' H ' ' HG2' ' A' ' 471' ' ' LYS . 36.4 t70 -57.85 -26.71 62.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.388 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 469' ' ' THR . 1.0 OUTLIER -83.05 -41.52 18.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.104 0.478 . . . . 0.0 111.37 -179.654 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.433 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 2.6 pp -83.98 -25.94 29.62 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -178.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.47 ' HD2' ' HB2' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -48.24 -33.59 8.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.685 0.279 . . . . 0.0 111.607 -178.986 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.453 ' HE2' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -87.5 -43.11 12.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.41 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.46 ' CG ' ' CG2' ' A' ' 454' ' ' VAL . 3.8 m-85 . . . . . 0 N--CA 1.454 -0.242 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.451 -0.385 0 CA-C-O 120.857 0.361 . . . . 0.0 111.058 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.42 150.83 0.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.916 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 6.3 t -61.43 -23.09 65.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.373 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.434 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 7.9 mt-10 -90.94 -48.44 7.0 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.598 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -45.18 94.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.257 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 91.1 m -49.56 -35.37 20.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.132 179.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 2.2 t -75.75 -44.1 39.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.078 179.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.15 -26.2 49.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.082 179.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.46 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 8.7 p -102.17 -15.29 7.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.085 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.473 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 1.8 tp -89.04 -42.52 11.7 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.106 0.479 . . . . 0.0 110.823 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.503 ' O ' ' HD2' ' A' ' 498' ' ' LYS . . . -51.29 -37.12 45.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.604 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.46 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.33 -37.88 89.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.668 -179.506 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.514 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 8.0 mt -78.73 -42.52 25.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.473 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 3.2 mm? -41.83 -50.4 4.39 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.503 ' HD2' ' O ' ' A' ' 494' ' ' ALA . 0.0 OUTLIER -61.18 -25.62 67.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.834 0.349 . . . . 0.0 111.593 -179.157 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.448 ' HG3' ' CG ' ' A' ' 456' ' ' GLU . 9.1 mmp_? -64.16 -19.04 65.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.969 0.414 . . . . 0.0 110.478 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.467 HD21 ' HD2' ' A' ' 460' ' ' ARG . 64.8 mt -62.13 -47.48 84.4 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.839 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.606 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.3 t-20 54.66 57.08 11.95 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.334 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.606 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 83.1 Cg_endo -102.24 -159.75 0.04 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.454 0 C-N-CA 123.967 3.111 . . . . 0.0 111.672 -179.251 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.05 140.44 51.0 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.659 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 35.4 ptt85 -79.52 134.59 36.5 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.342 0.591 . . . . 0.0 111.435 -178.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt -156.02 160.26 39.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.757 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 8.3 ptm -103.72 110.23 22.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.941 0.4 . . . . 0.0 111.555 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.523 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.68 110.88 22.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.882 179.011 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 56.0 t30 59.7 40.52 19.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.685 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 75.7 12.54 3.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.373 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.433 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.18 131.76 56.85 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.619 0.247 . . . . 0.0 111.003 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.67 108.7 1.03 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.057 0.456 . . . . 0.0 110.69 179.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.523 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 9.1 m80 -122.6 131.4 53.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.063 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.468 ' CE2' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -109.81 123.75 50.1 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.848 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.636 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -179.23 169.11 1.5 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.22 0.533 . . . . 0.0 112.236 -178.858 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.527 ' N ' HD21 ' A' ' 515' ' ' LEU . 1.4 pt? -119.33 169.23 10.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.44 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.423 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -139.26 106.3 5.45 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.987 0.422 . . . . 0.0 111.264 179.541 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.769 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 120.75 0.309 . . . . 0.0 111.459 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -53.8 -55.14 29.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.09 0.472 . . . . 0.0 111.367 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -80.15 -21.88 42.62 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.224 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.59 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 24.7 tp -48.33 -33.79 9.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.128 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 68.4 mt -85.89 -29.65 6.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.86 0.362 . . . . 0.0 110.512 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.55 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -63.7 -40.38 96.65 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.15 179.906 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.59 ' CD1' ' O ' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -80.16 -18.15 50.51 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.267 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -63.06 -30.91 71.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.863 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 9.6 pt-20 -80.63 -48.06 13.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.164 -179.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.56 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.3 pp -52.2 -26.63 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.168 0.508 . . . . 0.0 110.893 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.667 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.4 tp -69.53 -82.65 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.936 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.667 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 30.8 m . . . . . 0 N--CA 1.436 -1.138 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.319 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.493 ' CG2' ' CD2' ' A' ' 477' ' ' PHE . 1.4 t . . . . . 0 CA--C 1.519 -0.244 0 CA-C-O 120.926 0.393 . . . . 0.0 110.955 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 455' ' ' THR . . . . . 0.403 ' O ' HG22 ' A' ' 459' ' ' VAL . 33.1 p -131.56 169.12 16.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.609 0.718 . . . . 0.0 112.537 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.504 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 26.6 mt-10 -69.24 -53.49 19.6 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.591 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.66 -27.87 59.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.158 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.403 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -73.98 -32.36 63.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.589 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.509 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 10.2 t -76.02 -36.72 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.864 0.364 . . . . 0.0 111.091 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -54.9 -46.05 74.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.123 179.106 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.416 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.2 OUTLIER -64.25 -26.15 68.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.793 179.486 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.509 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 18.0 m-30 -72.02 -36.31 69.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.141 179.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.527 ' CD1' ' HB3' ' A' ' 500' ' ' LEU . 1.3 mt -75.33 -59.39 2.77 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.186 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.11 -27.41 0.95 Allowed 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.555 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -85.77 -52.85 5.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.784 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.45 ' HG3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -167.57 135.4 1.96 Allowed Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.575 -179.756 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.606 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 33.2 Cg_exo -53.74 176.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.014 1.809 . . . . 0.0 113.02 -179.19 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.508 ' HE2' ' CD1' ' A' ' 513' ' ' PHE . 0.0 OUTLIER -164.73 171.76 13.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.878 -177.439 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.504 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 1.4 p -112.21 157.95 20.28 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 177.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.416 ' CG2' HD23 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -59.17 -39.98 84.18 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.24 -0.584 . . . . 0.0 110.569 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -65.74 -50.91 63.07 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.765 178.942 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -62.9 -22.21 66.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.418 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.478 ' CD2' ' HG2' ' A' ' 468' ' ' MET . 10.7 mt -76.65 -46.26 26.56 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.434 HD22 ' CD1' ' B' ' 590' ' ' LEU . 0.5 OUTLIER -73.27 -50.7 20.82 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.761 0.315 . . . . 0.0 111.199 -179.169 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 23.8 mmtt -52.11 -25.19 8.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.185 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.604 ' HE2' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -70.47 -43.99 68.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.853 0.358 . . . . 0.0 110.499 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.604 ' CD2' ' HE2' ' A' ' 476' ' ' LYS . 15.5 m-85 . . . . . 0 CA--C 1.511 -0.555 0 CA-C-O 121.867 0.842 . . . . 0.0 109.874 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.415 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.448 0 CA-C-O 120.996 0.427 . . . . 0.0 111.366 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.13 161.13 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.589 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 23.4 p -60.18 -25.15 65.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.077 0.465 . . . . 0.0 109.951 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -90.45 -46.3 8.43 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.422 179.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.21 -41.95 98.84 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.889 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.496 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 88.6 m -50.76 -29.31 11.15 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.93 -41.14 16.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.293 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.58 -28.21 65.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.321 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.472 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 4.4 p -101.58 -7.57 9.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.957 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.497 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 3.4 tp -95.11 -35.89 11.72 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.943 0.402 . . . . 0.0 110.784 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.479 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -58.92 -38.99 80.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.175 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.472 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -66.64 -41.6 88.02 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.825 -179.338 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.504 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 12.7 mt -81.05 -30.07 11.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.497 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.0 OUTLIER -49.36 -56.93 7.91 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -178.622 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.472 ' N ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -61.86 -28.94 69.85 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -177.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.476 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 16.7 mmm180 -55.05 -22.16 14.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.059 0.457 . . . . 0.0 110.714 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.527 ' HB3' ' CD1' ' A' ' 463' ' ' LEU . 50.0 mt -63.15 -48.01 80.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.291 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.597 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.9 t-20 55.18 57.36 11.04 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.898 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.597 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 58.2 Cg_endo -100.36 -160.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.222 0 C-N-CA 124.083 3.189 . . . . 0.0 111.66 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.47 140.33 51.57 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.705 178.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -79.55 135.69 36.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.377 0.608 . . . . 0.0 111.535 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -154.69 147.46 24.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.747 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 6.9 ptm -90.14 108.77 19.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.011 0.434 . . . . 0.0 111.77 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.417 HG12 ' HB2' ' A' ' 512' ' ' HIS . 0.6 OUTLIER -92.7 110.77 23.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.884 178.872 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 59.63 40.39 20.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.932 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 77.11 10.31 2.55 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.524 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.437 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.6 tpmt? -116.09 131.83 56.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.594 0.235 . . . . 0.0 110.679 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 6.6 tpt -66.61 108.42 2.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.119 0.485 . . . . 0.0 111.052 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.504 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 12.1 m170 -122.74 137.9 54.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.225 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.519 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -118.54 122.97 43.95 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.698 0.285 . . . . 0.0 110.721 179.652 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.606 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -168.95 169.8 9.42 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.196 0.522 . . . . 0.0 111.993 -179.302 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.494 HD21 ' HB2' ' A' ' 463' ' ' LEU . 1.3 pt? -111.01 169.09 9.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.401 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -135.37 106.65 6.78 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.389 -0.524 . . . . 0.0 111.59 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.105 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' B' ' 589' ' ' HIS . 39.0 p-10 -50.75 -51.53 49.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.879 0.371 . . . . 0.0 111.843 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.42 ' N ' ' OD1' ' B' ' 588' ' ' ASP . 1.8 p-80 -80.52 -21.96 41.36 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.327 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.585 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 31.6 tp -54.69 -33.86 61.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.007 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . 0.419 HG23 HD13 ' B' ' 591' ' ' ILE . 83.2 mt -85.85 -29.62 6.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.896 0.379 . . . . 0.0 110.818 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.19 -40.72 96.7 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.382 -179.818 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.585 ' CD1' ' O ' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -78.91 -18.11 54.41 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.107 0.48 . . . . 0.0 110.211 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . 0.439 ' HA ' HG21 ' A' ' 470' ' ' THR . 79.8 tt0 -62.78 -32.66 73.86 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.001 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 8.0 pt-20 -79.5 -47.43 15.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.355 -179.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.573 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.0 pp -51.45 -26.7 6.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 120.965 0.412 . . . . 0.0 111.276 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.66 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.8 tp -69.87 -83.04 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.492 0.663 . . . . 0.0 111.435 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.66 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m . . . . . 0 N--CA 1.437 -1.083 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.527 -178.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.474 ' CG2' ' CG ' ' A' ' 477' ' ' PHE . 2.3 t . . . . . 0 CA--C 1.517 -0.311 0 CA-C-O 121.036 0.446 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 455' ' ' THR . . . . . 0.411 ' O ' HG21 ' A' ' 459' ' ' VAL . 28.4 p -132.1 163.0 29.44 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.516 0.674 . . . . 0.0 112.285 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.553 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 15.9 mt-10 -59.35 -54.53 45.74 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.126 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -28.25 19.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.777 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.429 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -77.65 -35.42 52.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.777 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.47 HG11 HD21 ' A' ' 473' ' ' LEU . 6.1 t -76.18 -34.85 26.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.684 0.278 . . . . 0.0 111.743 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.2 mmm180 -59.82 -37.22 78.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.643 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.3 OUTLIER -68.95 -31.75 70.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.138 179.313 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.478 ' O ' ' O ' ' A' ' 466' ' ' LYS . 14.7 m-30 -62.17 -45.01 95.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.095 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' A' ' 500' ' ' LEU . 0.3 OUTLIER -65.9 -59.23 4.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.09 179.774 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -49.24 -25.26 2.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.032 0.444 . . . . 0.0 110.424 179.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.566 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 45.5 ttt180 -90.98 -31.19 16.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.134 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.644 ' HE2' ' HD3' ' A' ' 467' ' ' PRO . 0.0 OUTLIER 167.15 167.91 0.11 Allowed Pre-proline 0 CA--C 1.532 0.253 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.592 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.754 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 84.5 Cg_endo -74.43 160.87 41.15 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.283 1.989 . . . . 0.0 114.113 -178.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.56 159.33 44.57 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 114.999 -1.001 . . . . 0.0 111.005 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.529 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 17.4 p -108.45 163.41 13.24 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.439 HG21 ' HA ' ' B' ' 594' ' ' GLU . 0.7 OUTLIER -64.63 -36.76 85.29 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.672 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.41 ' HA ' ' CD1' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -72.97 -50.22 24.61 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.42 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -61.12 -26.2 67.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.474 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.47 HD21 HG11 ' A' ' 459' ' ' VAL . 0.4 OUTLIER -69.1 -46.56 67.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.027 0.441 . . . . 0.0 111.152 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.427 ' CD2' ' CD1' ' B' ' 590' ' ' LEU . 2.1 pp -84.19 -31.87 24.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.589 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.52 -29.69 2.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.84 0.352 . . . . 0.0 110.922 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.457 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -93.12 -35.17 13.33 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.929 179.625 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.474 ' CG ' ' CG2' ' A' ' 454' ' ' VAL . 12.2 m-85 . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 6.1 tp . . . . . 0 N--CA 1.449 -0.484 0 CA-C-O 120.967 0.413 . . . . 0.0 110.983 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.37 145.81 0.16 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.888 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 3.1 t -58.29 -22.56 53.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.726 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -91.52 -48.75 6.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.716 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.05 -38.7 92.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.872 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.408 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 96.7 m -51.69 -30.08 20.64 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . 0.479 ' HA ' ' HB3' ' A' ' 493' ' ' LEU . 4.6 t -82.72 -40.07 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.087 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -60.53 -29.99 69.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.057 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.507 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 4.3 p -100.59 -6.98 9.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.94 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.532 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 16.7 tp -93.61 -40.17 10.42 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.073 0.463 . . . . 0.0 110.373 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.474 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -53.96 -42.12 68.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.381 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.507 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -62.47 -40.16 95.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.975 -179.328 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.482 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 10.2 mt -78.52 -41.67 25.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 112.559 0.578 . . . . 0.0 112.559 -178.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.532 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.0 OUTLIER -37.66 -58.73 0.86 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.524 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.471 ' H ' ' HD2' ' A' ' 498' ' ' LYS . 0.0 OUTLIER -59.44 -22.98 62.28 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.369 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.446 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 0.8 OUTLIER -63.56 -18.75 64.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 0.0 110.457 179.133 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.622 ' HB3' HD11 ' A' ' 463' ' ' LEU . 34.0 mt -62.69 -47.78 82.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.434 -179.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.638 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 28.0 t-20 55.22 54.52 9.94 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.197 -179.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.638 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 61.2 Cg_endo -101.72 -161.0 0.04 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 124.209 3.272 . . . . 0.0 111.712 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.76 139.87 51.62 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.565 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -79.53 132.45 36.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.451 0.643 . . . . 0.0 111.553 -178.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -156.27 130.07 8.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.841 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -76.47 112.29 12.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.908 0.385 . . . . 0.0 111.535 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.43 ' HB ' ' ND1' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.52 122.54 42.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.655 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . 0.404 ' O ' ' CB ' ' A' ' 509' ' ' ASP . 18.6 p30 48.91 37.56 10.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.436 -179.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . 0.404 ' CB ' ' O ' ' A' ' 508' ' ' ASN . 12.6 t70 80.12 13.03 0.97 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.563 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.435 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -116.28 131.48 56.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.594 179.715 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.05 108.29 1.02 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.087 0.47 . . . . 0.0 110.635 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.536 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 28.6 m80 -123.26 127.87 49.19 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.861 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.483 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.0 OUTLIER -104.92 123.73 48.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.803 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.754 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -178.33 169.47 1.82 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.407 0.622 . . . . 0.0 112.276 -178.756 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.546 ' CD2' ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -122.82 168.96 11.6 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.337 178.56 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.474 ' N ' HD21 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -129.97 106.06 8.4 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.207 0.527 . . . . 0.0 111.178 179.644 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.178 -0.915 . . . . 0.0 111.0 179.995 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.261 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -53.96 -55.11 30.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.008 0.432 . . . . 0.0 111.601 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.419 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 1.2 p-80 -77.49 -21.91 52.06 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.041 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.544 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 26.3 tp -58.47 -37.94 76.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.733 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 64.7 mt -86.01 -29.81 6.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.905 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.571 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.32 -40.83 86.0 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-O 121.063 0.459 . . . . 0.0 110.992 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.683 ' O ' HG13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -80.14 -18.16 50.55 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.957 179.781 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.41 -32.5 73.95 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.614 179.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 7.7 pt-20 -78.93 -46.87 17.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.385 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.683 HG13 ' O ' ' B' ' 593' ' ' LEU . 1.6 pp -50.76 -26.63 4.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.09 0.471 . . . . 0.0 110.911 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.663 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 14.2 tp -71.65 -82.58 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.618 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.663 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.439 -1.023 0 CA-C-N 114.59 -1.187 . . . . 0.0 110.66 -177.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.433 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.3 t . . . . . 0 CA--C 1.519 -0.232 0 CA-C-O 120.893 0.378 . . . . 0.0 110.682 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 33.4 p -131.67 172.89 11.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.704 0.764 . . . . 0.0 112.489 -179.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.506 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 18.2 mt-10 -69.18 -53.26 20.93 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.463 179.237 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -28.46 64.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.955 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.442 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -70.55 -34.34 72.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.569 -179.507 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.469 ' HB ' HD21 ' A' ' 500' ' ' LEU . 18.6 t -76.15 -37.46 32.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.768 0.318 . . . . 0.0 111.369 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.7 mmm-85 -54.49 -44.57 72.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.073 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.481 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -62.83 -29.25 70.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.446 179.4 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.481 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 10.5 m-30 -68.94 -44.63 72.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.114 0.483 . . . . 0.0 109.909 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.49 ' CD1' HD21 ' A' ' 515' ' ' LEU . 0.7 OUTLIER -67.31 -59.78 3.13 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.224 -179.858 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 17.9 p -47.34 -27.38 1.59 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.009 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.4 mtp85 -88.68 -40.76 13.04 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.015 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.48 ' HD2' ' O ' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -175.96 146.39 0.82 Allowed Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.913 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.694 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 39.9 Cg_endo -65.02 151.76 84.68 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.66 2.24 . . . . 0.0 113.115 -179.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.456 ' HE3' ' CD1' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -147.7 163.83 35.46 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.338 0.589 . . . . 0.0 112.072 -179.317 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.492 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 3.0 p -107.62 160.68 15.51 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.177 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.418 HG23 ' CD2' ' B' ' 593' ' ' LEU . 0.2 OUTLIER -53.26 -46.65 69.31 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.865 -179.641 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.441 ' HG2' ' CD2' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -58.97 -57.02 14.91 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.03 179.287 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -60.57 -26.73 67.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.759 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.456 ' CD1' ' HE3' ' A' ' 468' ' ' MET . 1.5 tt -77.92 -43.9 28.59 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.02 0.438 . . . . 0.0 111.498 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 2.9 pp -84.07 -32.9 24.55 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.251 -179.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.413 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.1 OUTLIER -50.54 -33.4 21.53 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.801 0.334 . . . . 0.0 111.433 -179.428 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.417 ' HE2' ' CE2' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -75.21 -42.02 56.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.338 -179.681 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.433 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.4 m-85 . . . . . 0 N--CA 1.454 -0.249 0 CA-C-O 121.035 0.445 . . . . 0.0 110.997 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.45 -0.454 0 CA-C-O 120.98 0.419 . . . . 0.0 111.001 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.22 149.92 0.47 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.561 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.47 -23.31 57.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.176 178.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . 0.419 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 15.5 mt-10 -86.53 -55.06 4.05 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.613 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -60.0 -40.72 90.19 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.241 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.407 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 97.7 m -50.55 -33.37 21.53 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 4.5 t -76.82 -42.68 33.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.873 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -57.19 -25.97 59.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.391 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.526 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 8.0 p -100.57 -14.92 7.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.266 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.416 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 0.2 OUTLIER -91.36 -32.32 15.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.009 0.433 . . . . 0.0 110.462 179.893 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.487 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -59.3 -39.84 84.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.8 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.526 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.5 OUTLIER -65.88 -41.4 91.61 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.679 -179.59 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.514 ' HA ' ' HG2' ' A' ' 499' ' ' ARG . 8.8 mt -78.42 -32.29 16.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.423 ' HB3' ' CD1' ' B' ' 597' ' ' LEU . 1.1 mm? -49.89 -49.85 48.09 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 -178.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.457 ' N ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -66.49 -29.07 69.09 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.194 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.514 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.4 mmm180 -58.22 -21.69 48.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.992 0.425 . . . . 0.0 110.453 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.469 HD21 ' HB ' ' A' ' 459' ' ' VAL . 37.9 mt -60.74 -47.45 86.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.858 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.572 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.0 t-20 56.33 58.56 9.04 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.6 -179.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.572 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 95.5 Cg_endo -100.91 -158.95 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 124.027 3.151 . . . . 0.0 111.391 -179.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.92 139.98 52.48 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.756 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.47 134.24 36.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.381 0.61 . . . . 0.0 111.407 -178.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -156.12 160.16 39.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.717 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.83 109.36 21.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.901 0.381 . . . . 0.0 111.591 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.494 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.67 110.91 22.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.92 179.072 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 59.58 43.21 16.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.697 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 72.93 12.38 5.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.337 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.435 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.7 tpmt? -116.12 132.8 56.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.634 0.254 . . . . 0.0 110.918 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.23 108.8 1.67 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.999 0.428 . . . . 0.0 110.715 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.494 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 15.9 m80 -122.64 124.87 44.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.034 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.484 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -105.65 123.81 48.54 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.565 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.694 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -178.81 169.18 1.65 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.162 0.506 . . . . 0.0 112.153 -178.52 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.518 HD22 ' N ' ' A' ' 515' ' ' LEU . 1.5 pt? -118.95 169.23 10.06 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.452 179.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.402 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -139.78 106.31 5.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.994 0.426 . . . . 0.0 111.33 179.606 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.907 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' B' ' 590' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 p30 -58.24 -39.68 79.77 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.509 ' HD2' ' N ' ' B' ' 590' ' ' LEU . 1.0 OUTLIER -80.03 -21.0 44.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.528 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.525 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 17.3 tp -48.43 -29.82 4.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.024 0.44 . . . . 0.0 110.624 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 72.8 mt -85.58 -29.55 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.623 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.586 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.35 -42.83 99.34 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.433 -179.705 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.638 ' O ' HG13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -78.58 -17.71 55.7 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.225 0.536 . . . . 0.0 109.845 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.15 -33.8 76.25 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.671 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 7.1 pt-20 -78.6 -46.99 18.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.636 -178.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.638 HG13 ' O ' ' B' ' 593' ' ' LEU . 1.5 pp -49.79 -26.68 2.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.101 0.477 . . . . 0.0 111.124 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.661 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.4 tp -72.32 -82.44 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.68 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.661 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.9 m . . . . . 0 N--CA 1.438 -1.036 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.774 -177.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.449 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.5 t . . . . . 0 CA--C 1.517 -0.323 0 CA-C-O 121.04 0.448 . . . . 0.0 110.917 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 32.2 p -131.83 168.07 18.47 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.65 0.738 . . . . 0.0 112.233 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.494 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 23.6 mt-10 -62.53 -52.96 61.39 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.315 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -28.46 68.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.251 -179.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.458 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -67.68 -38.14 83.3 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.863 0.363 . . . . 0.0 111.322 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.446 HG13 HD22 ' A' ' 500' ' ' LEU . 21.0 t -72.38 -32.86 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.947 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.5 OUTLIER -56.61 -49.61 74.44 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 178.636 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.458 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -59.01 -25.02 63.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.727 179.543 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.441 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 14.7 m-30 -73.17 -46.54 50.16 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.108 0.48 . . . . 0.0 109.734 178.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.508 ' CD1' HD22 ' A' ' 515' ' ' LEU . 0.6 OUTLIER -65.72 -57.91 6.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.233 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 464' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 460' ' ' ARG . 0.0 OUTLIER -48.26 -27.76 2.67 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.087 0.47 . . . . 0.0 110.506 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . 0.561 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 31.0 ttt85 -87.98 -32.64 18.74 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.806 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.561 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER 169.29 153.15 0.15 Allowed Pre-proline 0 CA--C 1.53 0.21 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.746 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.706 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 40.3 Cg_endo -64.96 165.45 21.42 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.64 2.227 . . . . 0.0 113.595 -179.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.502 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -159.46 152.78 22.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.407 -179.125 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.503 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 12.3 p -96.82 155.87 16.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.496 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.0 OUTLIER -51.02 -45.86 61.4 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.888 -179.662 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.433 ' HG2' ' CD2' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -59.37 -53.73 54.87 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.033 178.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -61.43 -33.41 73.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.625 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.502 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 0.9 OUTLIER -71.01 -41.39 70.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.981 0.42 . . . . 0.0 111.5 -179.583 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.477 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 2.4 pp -84.39 -34.77 23.5 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.997 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.429 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -48.96 -31.81 8.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.716 0.293 . . . . 0.0 111.413 -179.385 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.47 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -81.14 -33.84 32.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.238 -179.871 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.47 ' CE2' ' HE2' ' A' ' 476' ' ' LYS . 15.1 m-85 . . . . . 0 N--CA 1.455 -0.217 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 19.2 tp . . . . . 0 N--CA 1.448 -0.569 0 CA-C-O 120.973 0.416 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.86 143.87 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.789 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.88 -22.07 61.85 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.97 0.414 . . . . 0.0 110.002 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -82.69 -52.83 6.42 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.778 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -63.5 -38.79 92.47 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.978 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 93.0 m -51.45 -30.38 19.41 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 4.2 t -79.09 -43.15 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.032 179.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -57.12 -25.93 59.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.602 179.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.506 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.6 p -100.85 -13.83 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.307 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.517 ' CD1' ' CD2' ' A' ' 497' ' ' LEU . 0.5 OUTLIER -89.33 -37.07 15.17 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.086 0.469 . . . . 0.0 110.452 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.466 ' HB2' ' CD1' ' B' ' 596' ' ' ILE . . . -55.32 -40.22 70.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.386 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.506 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -63.99 -41.27 97.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.156 -179.171 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.494 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 9.4 mt -75.08 -45.84 41.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.517 ' CD2' ' CD1' ' A' ' 493' ' ' LEU . 3.2 mm? -36.3 -59.79 0.61 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.493 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.81 -30.16 68.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.774 0.321 . . . . 0.0 111.809 -178.85 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.41 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 1.2 tpt180 -60.29 -24.34 64.88 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.957 0.408 . . . . 0.0 110.75 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.457 ' CD1' HD12 ' A' ' 463' ' ' LEU . 52.2 mt -61.07 -47.22 87.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.69 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.566 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 50.2 t-20 58.45 59.12 6.1 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.962 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.566 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 71.5 Cg_endo -101.56 -160.1 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 124.045 3.164 . . . . 0.0 111.441 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.82 139.4 53.2 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 505' ' ' LYS . 7.9 ptt85 -79.69 131.54 35.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.482 0.658 . . . . 0.0 111.758 -178.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' A' ' 504' ' ' ARG . 0.1 OUTLIER -148.26 160.13 43.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.406 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 506' ' ' MET . . . . . 0.402 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 7.2 ptm -105.03 108.84 20.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.92 0.391 . . . . 0.0 111.295 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.496 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.59 110.88 22.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.011 179.274 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 59.7 41.65 18.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.793 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.9 t0 73.95 13.85 4.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.209 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.443 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.11 132.01 56.78 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.926 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.15 108.7 1.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.095 0.474 . . . . 0.0 110.658 179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.536 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 19.7 m80 -122.8 127.12 48.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.107 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.463 ' CD1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.54 123.91 48.81 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.646 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.706 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -177.52 169.39 2.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.254 0.55 . . . . 0.0 112.441 -178.66 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.531 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.4 pt? -117.4 169.18 9.71 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.213 -0.903 . . . . 0.0 108.942 178.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . 0.429 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -138.0 106.45 5.82 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.479 179.787 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.761 179.948 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . 0.429 ' OD1' ' N ' ' B' ' 589' ' ' HIS . 14.5 p-10 -50.7 -50.26 55.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.883 0.373 . . . . 0.0 111.874 -178.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . 0.429 ' N ' ' OD1' ' B' ' 588' ' ' ASP . 1.0 OUTLIER -80.53 -23.72 39.83 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.353 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.539 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 24.9 tp -55.15 -35.76 65.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.971 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 67.7 mt -85.88 -29.72 6.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.901 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.539 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.79 -42.62 81.36 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.474 -179.686 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.558 ' C ' ' CD2' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -75.33 -22.16 57.84 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.2 0.524 . . . . 0.0 109.925 179.559 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 72.4 tt0 -63.32 -30.87 71.93 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.888 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . 0.43 ' HG3' ' N ' ' B' ' 596' ' ' ILE . 0.0 OUTLIER -76.89 -36.88 56.38 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.362 -179.038 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.475 HD11 ' HB2' ' A' ' 494' ' ' ALA . 4.0 pt -61.4 -26.54 39.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.114 0.483 . . . . 0.0 111.183 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.653 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.6 tp -72.83 -81.86 0.05 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.03 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.653 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.2 m . . . . . 0 N--CA 1.438 -1.05 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.724 -177.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.448 HG23 ' CD2' ' A' ' 477' ' ' PHE . 3.4 t . . . . . 0 CA--C 1.516 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 30.4 p -131.84 167.32 19.77 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.665 0.745 . . . . 0.0 112.449 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.538 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 19.2 mt-10 -63.04 -53.47 53.25 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 114.561 -1.199 . . . . 0.0 110.505 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.37 -28.28 65.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.88 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.438 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -72.63 -34.31 67.22 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.779 -179.462 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.466 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 18.3 t -75.97 -36.77 32.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.476 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.5 OUTLIER -54.51 -45.46 73.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.932 0.396 . . . . 0.0 110.131 179.135 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.482 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -62.16 -29.31 70.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.891 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.482 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 10.7 m-30 -68.3 -44.13 76.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.072 0.463 . . . . 0.0 110.178 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.48 HD11 ' CD1' ' A' ' 500' ' ' LEU . 0.5 OUTLIER -67.24 -59.25 3.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.305 -179.657 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -49.58 -26.25 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.99 0.424 . . . . 0.0 110.572 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -90.07 -46.22 8.63 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.009 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.514 ' HE2' ' HG2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -171.78 131.02 0.73 Allowed Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.916 -179.584 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.652 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 10.7 Cg_endo -52.51 163.25 1.86 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.366 2.044 . . . . 0.0 112.405 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.597 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -157.39 159.12 37.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.245 0.545 . . . . 0.0 112.102 -178.609 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.499 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 5.1 p -102.54 155.59 18.17 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.161 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.515 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -51.77 -43.98 63.2 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.859 -179.485 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.548 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -60.54 -58.81 6.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.284 0.564 . . . . 0.0 109.735 178.855 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.16 -20.28 39.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.498 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.597 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 0.5 OUTLIER -87.57 -40.76 13.98 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.887 0.375 . . . . 0.0 111.702 -179.575 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.432 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 1.3 pp -84.03 -49.73 8.65 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.504 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 18.3 mmtp -48.72 -25.34 1.76 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.76 0.314 . . . . 0.0 111.475 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.472 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -81.55 -43.59 18.52 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.722 179.818 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.472 ' CE2' ' HE2' ' A' ' 476' ' ' LYS . 8.3 m-85 . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 121.092 0.473 . . . . 0.0 110.938 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 1.3 tp . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.997 0.427 . . . . 0.0 111.503 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.14 154.95 0.33 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.401 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 5.1 p -61.25 -26.3 67.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.515 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -90.73 -42.34 10.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.611 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -65.73 -40.99 92.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.092 179.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.452 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 89.5 m -50.28 -29.42 9.63 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 10.1 t -82.66 -40.85 17.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.004 179.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -58.34 -28.2 64.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.389 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.459 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 4.0 p -102.15 -8.89 9.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.384 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.497 ' CD1' ' CD2' ' A' ' 497' ' ' LEU . 2.3 tp -93.31 -40.59 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.043 0.449 . . . . 0.0 110.908 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.475 ' HB2' HD11 ' B' ' 596' ' ' ILE . . . -53.26 -45.23 68.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.279 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.459 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -58.84 -35.99 73.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.001 -179.447 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.538 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 8.6 mt -81.94 -32.25 11.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.515 ' HG ' ' CG2' ' A' ' 470' ' ' THR . 3.5 mm? -50.98 -48.37 61.2 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.478 ' N ' HD11 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -62.02 -32.44 72.93 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -178.72 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.505 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 0.9 OUTLIER -57.74 -23.44 52.06 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.954 0.407 . . . . 0.0 110.526 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.48 ' CD1' HD11 ' A' ' 463' ' ' LEU . 50.8 mt -59.92 -47.36 86.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.698 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.583 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.0 t-20 55.91 57.96 9.79 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.44 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.583 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 87.9 Cg_endo -101.38 -160.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 123.879 3.052 . . . . 0.0 111.485 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.61 141.15 48.87 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.625 178.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -79.42 133.66 36.55 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.396 0.617 . . . . 0.0 111.368 -178.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -156.15 160.13 39.63 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.842 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -105.16 110.27 22.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.902 0.382 . . . . 0.0 111.509 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.531 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.65 110.92 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.781 178.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.5 44.27 15.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.74 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 71.72 13.04 6.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.318 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.445 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.7 tpmt? -116.17 132.03 56.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.644 -0.253 . . . . 0.0 110.886 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.3 108.66 1.35 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.993 0.425 . . . . 0.0 110.589 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.531 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 16.5 m80 -122.68 125.29 45.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.248 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.473 ' CE1' HD22 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -105.22 123.55 48.02 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.516 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.652 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -177.98 169.38 1.97 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.151 0.501 . . . . 0.0 112.21 -178.896 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.509 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.3 pt? -116.57 169.16 9.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.286 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.45 106.43 6.65 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.026 0.441 . . . . 0.0 111.35 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.121 179.923 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 120.787 0.327 . . . . 0.0 111.532 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -51.02 -55.0 19.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.069 0.461 . . . . 0.0 111.611 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -79.57 -21.82 44.59 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.205 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 590' ' ' LEU . . . . . 0.628 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 37.9 tp -52.68 -29.56 27.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.937 0.399 . . . . 0.0 111.05 -179.936 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 97.3 mt -85.41 -29.5 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 CA-C-O 120.975 0.417 . . . . 0.0 110.786 -179.892 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 592' ' ' TYR . . . . . 0.6 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.91 -45.61 85.16 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.849 -179.507 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 593' ' ' LEU . . . . . 0.628 ' CD1' ' O ' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -70.02 -18.22 63.3 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.972 0.415 . . . . 0.0 110.373 -179.704 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 594' ' ' GLU . . . . . 0.479 ' HA ' HG21 ' A' ' 470' ' ' THR . 62.5 tt0 -62.8 -30.79 71.74 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 120.853 0.358 . . . . 0.0 110.913 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -80.19 -46.2 16.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.038 -179.343 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 596' ' ' ILE . . . . . 0.55 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.3 pp -54.91 -26.54 17.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.944 0.402 . . . . 0.0 111.147 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 597' ' ' LEU . . . . . 0.657 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 14.8 tp -69.17 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.436 0.636 . . . . 0.0 111.833 179.996 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 598' ' ' VAL . . . . . 0.657 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.5 m . . . . . 0 N--CA 1.437 -1.096 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.593 -177.8 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.461 HG23 ' CD2' ' A' ' 477' ' ' PHE . 62.6 t . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 120.778 0.323 . . . . 0.0 110.575 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 455' ' ' THR . . . . . 0.406 ' O ' HG23 ' A' ' 459' ' ' VAL . 16.9 p -131.68 158.29 41.49 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.552 0.691 . . . . 0.0 112.483 -179.336 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 456' ' ' GLU . . . . . 0.525 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 17.1 mt-10 -50.19 -52.46 35.46 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.655 -1.157 . . . . 0.0 111.171 179.425 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.97 -30.75 71.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.376 -179.196 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 458' ' ' ALA . . . . . 0.454 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -70.52 -56.8 5.7 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.765 0.317 . . . . 0.0 111.461 -179.523 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.518 ' O ' ' HG ' ' A' ' 463' ' ' LEU . 21.0 t -48.84 -26.47 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.711 0.291 . . . . 0.0 111.221 -179.574 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 460' ' ' ARG . . . . . 0.513 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.7 OUTLIER -61.73 -49.78 75.06 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.547 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 461' ' ' ARG . . . . . 0.488 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -57.94 -30.75 66.22 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.402 179.351 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 462' ' ' TYR . . . . . 0.495 ' CE2' ' CE2' ' A' ' 477' ' ' PHE . 8.5 m-30 -64.54 -42.58 95.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.189 0.518 . . . . 0.0 109.739 178.867 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 463' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 459' ' ' VAL . 0.8 OUTLIER -71.84 -57.89 3.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.291 -179.9 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.07 -26.44 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.812 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -91.65 -50.68 5.63 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.116 179.785 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 466' ' ' LYS . . . . . 0.412 ' CE ' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -168.18 132.99 1.47 Allowed Pre-proline 0 N--CA 1.452 -0.352 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.054 -179.774 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 467' ' ' PRO . . . . . 0.556 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 37.1 Cg_exo -57.38 146.71 81.63 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.374 2.049 . . . . 0.0 113.116 -179.606 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 468' ' ' MET . . . . . 0.511 ' SD ' ' CD1' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -128.97 177.14 7.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.968 -179.571 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 469' ' ' THR . . . . . 0.541 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 1.4 p -115.06 157.16 23.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.919 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 470' ' ' THR . . . . . 0.492 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.6 OUTLIER -54.56 -39.56 67.86 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 120.159 -0.617 . . . . 0.0 110.664 -179.602 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.749 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -68.97 -60.39 2.4 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.253 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -52.96 -24.94 10.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.192 179.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 473' ' ' LEU . . . . . 0.553 ' HA ' ' NZ ' ' A' ' 476' ' ' LYS . 0.7 OUTLIER -69.98 -40.1 75.56 Favored 'General case' 0 CA--C 1.523 -0.069 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.526 -179.438 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.434 ' CD2' ' CD1' ' B' ' 590' ' ' LEU . 0.9 OUTLIER -84.78 -25.69 28.04 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -179.499 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 475' ' ' LYS . . . . . 0.749 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 68.6 mmtt -57.68 -44.49 85.82 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -178.828 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 476' ' ' LYS . . . . . 0.553 ' NZ ' ' HA ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -74.39 -43.48 56.21 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.596 179.927 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 477' ' ' PHE . . . . . 0.553 ' N ' ' HG2' ' A' ' 476' ' ' LYS . 5.1 m-85 . . . . . 0 CA--C 1.511 -0.521 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.062 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.405 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.451 -0.396 0 CA-C-O 120.701 0.286 . . . . 0.0 111.098 . . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -39.35 153.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.969 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.99 -26.15 67.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.261 179.256 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -88.73 -45.95 9.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.382 179.537 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 488' ' ' GLN . . . . . 0.403 ' HA ' ' HB3' ' A' ' 491' ' ' ASN . 1.5 mt-30 -63.48 -41.08 98.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.921 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 489' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 86.0 m -50.28 -30.51 12.03 Favored 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.637 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 490' ' ' VAL . . . . . 0.424 ' HA ' ' HB3' ' A' ' 493' ' ' LEU . 7.0 t -83.02 -40.43 16.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.001 179.034 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 491' ' ' ASN . . . . . 0.403 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 5.2 t30 -60.98 -30.87 70.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.938 178.928 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 492' ' ' VAL . . . . . 0.473 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 5.4 p -98.46 -6.85 9.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.887 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.504 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 19.8 tp -95.27 -42.01 8.76 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.994 0.426 . . . . 0.0 110.61 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . 0.437 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -54.45 -33.8 60.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.507 -179.921 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.473 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -67.84 -42.79 80.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.125 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 496' ' ' ILE . . . . . 0.525 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 12.9 mt -76.08 -46.89 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 112.368 0.506 . . . . 0.0 112.368 -179.06 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . 0.504 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.0 OUTLIER -32.85 -64.33 0.19 Allowed 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -178.483 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 498' ' ' LYS . . . . . 0.492 ' N ' HD11 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -61.47 -31.64 71.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.907 0.384 . . . . 0.0 111.575 -178.956 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 499' ' ' ARG . . . . . 0.423 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 2.4 tpt180 -57.59 -23.42 50.77 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.961 179.79 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . 0.448 ' CD1' HD13 ' A' ' 463' ' ' LEU . 53.1 mt -62.37 -47.5 83.91 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.819 -179.366 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.584 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 50.9 t-20 56.5 58.31 8.83 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.787 -179.349 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 502' ' ' PRO . . . . . 0.584 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 65.2 Cg_endo -101.2 -158.97 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.338 0 C-N-CA 124.097 3.198 . . . . 0.0 111.536 -179.505 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.15 141.91 47.99 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.76 178.881 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.57 135.49 36.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.282 0.563 . . . . 0.0 111.44 -179.026 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -155.26 157.44 37.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.809 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 7.4 ptm -105.13 108.93 20.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.994 0.426 . . . . 0.0 111.598 -179.728 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 507' ' ' ILE . . . . . 0.417 HG12 ' HB2' ' A' ' 512' ' ' HIS . 1.2 mm -90.94 110.77 22.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.082 179.225 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.7 t30 59.03 40.35 22.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.764 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 2.7 t70 76.62 12.12 2.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.359 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.441 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.6 tpmt? -116.17 130.65 56.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.765 0.317 . . . . 0.0 110.925 179.696 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 45.3 mmm -65.7 108.92 2.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.983 0.421 . . . . 0.0 111.023 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . 0.541 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 15.1 m170 -122.15 135.35 54.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.289 179.512 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 513' ' ' PHE . . . . . 0.549 ' CE2' ' CD2' ' B' ' 597' ' ' LEU . 0.0 OUTLIER -110.55 123.44 49.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.664 0.269 . . . . 0.0 111.08 -179.896 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 514' ' ' SER . . . . . 0.556 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 2.1 m -174.51 169.57 3.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.475 0.655 . . . . 0.0 112.563 -179.691 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 515' ' ' LEU . . . . . 0.492 HD22 ' HB2' ' A' ' 463' ' ' LEU . 1.1 pt? -114.35 169.04 9.33 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.551 178.599 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.42 106.54 7.94 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.507 179.849 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.215 -0.897 . . . . 0.0 111.076 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.851 0.358 . . . . 5.87 111.156 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -61.44 90.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 3.92 110.914 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -90.06 49.63 1.74 Allowed 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.007 0.432 . . . . 2.46 110.712 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.47 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 16.4 pt-20 -86.19 -36.79 19.27 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.966 -0.561 . . . . 2.3 110.764 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.13 -22.64 31.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.681 -0.69 . . . . 2.32 111.605 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -51.01 -55.06 19.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.993 0.425 . . . . 1.89 111.626 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.47 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.1 p-80 -79.07 -21.85 46.17 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.749 -0.66 . . . . 0.6 111.183 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.561 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 28.2 tp -56.44 -33.37 65.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 1.14 110.811 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.1 mt -85.71 -29.71 6.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.267 -0.424 . . . . 1.33 110.804 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.571 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.74 -44.32 86.34 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.142 -0.481 . . . . 2.23 111.446 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.638 ' O ' HG13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -75.22 -17.94 60.23 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.128 0.489 . . . . 1.14 110.032 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.17 -30.78 71.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.005 -0.543 . . . . 1.77 110.853 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.506 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 3.7 pt-20 -82.87 -43.92 16.02 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.608 0.596 . . . . 1.85 112.608 -178.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.638 HG13 ' O ' ' B' ' 593' ' ' LEU . 1.6 pp -51.07 -26.61 4.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.059 0.456 . . . . 1.23 111.231 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.659 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.2 tp -71.32 -82.7 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.527 0.68 . . . . 1.13 111.733 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.659 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -141.85 30.4 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 CA-C-N 114.565 -1.198 . . . . 1.12 110.642 -177.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.506 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 28.7 mtp180 -140.41 40.79 1.9 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.545 -0.752 . . . . 2.68 111.205 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 31.3 m . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.247 -0.883 . . . . 2.25 111.111 179.949 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.886 0.374 . . . . 4.57 111.159 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . 0.415 ' O ' ' HA ' ' A' ' 482' ' ' THR . 8.3 p -61.99 144.1 14.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 2.48 111.051 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -118.77 138.17 52.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.326 -0.397 . . . . 2.35 110.988 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.455 HG22 ' CD2' ' A' ' 477' ' ' PHE . 14.2 t -71.04 110.57 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-N 116.163 -0.471 . . . . 1.32 110.78 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 28.7 p -131.71 165.34 23.95 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.613 0.72 . . . . 1.09 112.424 -179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.516 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 18.2 mt-10 -60.16 -53.23 60.22 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 114.557 -1.201 . . . . 1.25 110.566 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.32 -28.89 68.49 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.261 -0.881 . . . . 1.29 112.162 -179.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.491 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -71.3 -37.68 71.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.453 -0.34 . . . . 1.07 111.734 -179.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.443 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 21.9 t -72.52 -32.32 41.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.842 -0.343 . . . . 1.11 111.541 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.516 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -58.12 -39.56 79.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.391 -0.368 . . . . 3.05 110.429 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.491 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -67.12 -29.59 69.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 3.01 110.478 179.816 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.443 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 5.0 m-30 -69.27 -39.74 78.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 2.16 110.242 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.556 ' HB2' ' CD2' ' A' ' 515' ' ' LEU . 2.0 mt -69.89 -63.67 1.03 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.706 -0.679 . . . . 1.08 111.733 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.62 -26.31 1.45 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 1.19 110.929 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -88.13 -46.81 8.97 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.896 -0.593 . . . . 3.79 111.221 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.8 OUTLIER -170.06 133.94 1.13 Allowed Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.573 -0.285 . . . . 4.39 110.891 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.662 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 13.9 Cg_endo -54.83 156.22 15.81 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.444 2.096 . . . . 0.84 112.612 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.488 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.47 163.02 39.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.317 0.58 . . . . 1.4 111.899 -179.111 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.502 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 4.3 p -106.11 158.92 16.47 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.819 -1.178 . . . . 1.27 107.819 177.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.5 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.4 OUTLIER -53.49 -46.62 70.08 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.291 -0.564 . . . . 1.23 110.95 -179.658 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.422 ' HG2' ' CD2' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -59.53 -52.02 67.37 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.885 -0.598 . . . . 1.87 110.267 179.171 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -63.61 -32.05 73.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.775 -0.648 . . . . 1.14 111.563 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.488 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 0.9 OUTLIER -71.55 -39.39 70.71 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.998 0.428 . . . . 1.58 111.354 -179.657 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.501 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 1.4 pp -83.59 -43.43 15.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.953 -0.567 . . . . 1.24 111.548 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.29 -33.98 44.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.5 -0.318 . . . . 3.05 111.314 -179.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.434 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -69.52 -39.67 77.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.384 -0.371 . . . . 2.58 111.249 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.455 ' CD2' HG22 ' A' ' 454' ' ' VAL . 15.2 m-85 -66.13 -66.73 0.51 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.493 0.663 . . . . 2.12 110.102 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 51.1 174.7 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.733 -1.121 . . . . 2.54 111.599 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 8.1 m -75.11 0.37 16.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.955 -0.566 . . . . 3.5 111.488 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -45.03 -39.49 5.73 Favored 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 111.942 0.349 . . . . 5.56 111.942 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt -139.24 -47.09 0.47 Allowed 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.871 0.322 . . . . 3.54 111.871 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' THR . . . . . 0.415 ' HA ' ' O ' ' A' ' 452' ' ' VAL . 12.4 p -53.54 -16.11 1.39 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.61 -0.268 . . . . 1.38 111.263 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 62.14 19.54 59.44 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.377 -0.916 . . . . 0.8 111.224 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.403 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 3.4 mp -104.39 123.71 47.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 120.94 0.4 . . . . 1.56 111.226 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.55 157.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.748 -0.66 . . . . 1.03 111.688 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.4 -24.35 67.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 1.98 110.154 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.427 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 8.7 mt-10 -90.78 -45.17 8.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.779 -0.646 . . . . 1.53 110.544 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -63.38 -42.78 98.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.58 -0.736 . . . . 1.25 110.052 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 93.4 m -50.19 -28.59 7.76 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.086 0.469 . . . . 1.17 109.747 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 5.1 t -84.73 -41.27 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.562 -0.745 . . . . 1.13 109.982 179.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -57.89 -26.13 61.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.265 -0.88 . . . . 0.47 110.374 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.523 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 3.6 p -101.96 -14.41 8.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.871 -0.604 . . . . 1.07 111.103 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.501 ' CD2' ' HB3' ' A' ' 474' ' ' LEU . 1.4 tp -88.83 -35.98 16.28 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.059 0.456 . . . . 1.63 110.585 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.485 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -56.08 -41.97 75.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.556 . . . . 1.05 111.305 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.523 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.21 -38.59 91.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.864 -0.607 . . . . 0.83 112.259 -179.212 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.526 ' HA ' ' HG2' ' A' ' 499' ' ' ARG . 9.7 mt -79.84 -30.45 13.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 112.922 0.712 . . . . 1.14 112.922 -178.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.5 ' HG ' ' CG2' ' A' ' 470' ' ' THR . 1.1 mm? -49.93 -54.12 21.81 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.048 0.388 . . . . 1.26 112.048 -178.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.473 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.98 -29.97 68.8 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.504 0.557 . . . . 1.34 112.504 -178.336 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.526 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.7 mmm180 -60.48 -22.81 63.93 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.998 0.428 . . . . 2.8 110.475 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.496 ' HB3' ' CD1' ' A' ' 463' ' ' LEU . 77.0 mt -61.15 -47.56 85.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.779 -0.646 . . . . 1.09 111.841 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.608 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.5 t-20 55.89 56.3 9.78 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.028 -0.533 . . . . 0.73 110.051 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.608 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 49.2 Cg_endo -99.55 -160.35 0.04 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 123.965 3.11 . . . . 0.28 111.518 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.81 140.83 49.31 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 116.042 -0.526 . . . . 1.17 109.769 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.57 134.46 36.47 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.384 0.611 . . . . 3.22 111.463 -179.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -156.11 160.14 39.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.105 -0.952 . . . . 1.49 109.727 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' MET . . . . . 0.406 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.7 OUTLIER -105.04 110.09 22.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.875 0.369 . . . . 1.18 111.643 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.514 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.74 110.9 22.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 1.1 109.872 179.04 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 32.6 t30 59.12 44.15 16.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.323 -0.398 . . . . 1.87 110.829 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 72.02 13.08 5.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.121 -0.49 . . . . 1.66 111.414 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.434 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.11 132.95 56.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.616 -0.266 . . . . 1.87 110.885 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.98 108.67 1.56 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.028 0.442 . . . . 1.52 110.747 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.514 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 16.1 m80 -122.75 124.92 44.47 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 2.21 111.026 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.488 ' CD1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.08 123.54 48.16 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.765 -0.457 . . . . 2.17 109.765 178.676 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.662 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER 179.6 169.33 1.12 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.163 0.506 . . . . 1.03 111.936 -178.907 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.556 ' CD2' ' HB2' ' A' ' 463' ' ' LEU . 0.4 OUTLIER -110.83 169.52 8.7 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.541 -0.754 . . . . 2.15 110.249 179.0 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.31 105.39 4.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.172 0.51 . . . . 1.75 110.867 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.244 -0.884 . . . . 3.33 110.993 -179.956 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.759 0.314 . . . . 0.0 111.149 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -64.97 79.69 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.898 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . 0.411 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 3.5 t70 -89.98 49.57 1.73 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.981 0.42 . . . . 0.0 110.789 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.461 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 1.0 OUTLIER -86.11 -38.31 17.9 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.839 179.52 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.13 -22.75 30.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.578 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -53.3 -55.02 28.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.021 0.438 . . . . 0.0 111.546 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.461 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.0 OUTLIER -79.83 -21.77 43.81 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.254 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.539 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 30.0 tp -50.86 -35.43 32.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.184 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 75.3 mt -85.89 -29.42 6.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.898 0.38 . . . . 0.0 110.908 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.535 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.21 -45.23 95.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.294 -179.793 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.614 ' HA ' HG12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -78.6 -18.53 54.42 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.958 0.409 . . . . 0.0 110.35 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' B' ' 599' ' ' ARG . 69.1 tt0 -63.19 -30.97 72.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.962 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.47 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 6.8 pt-20 -82.43 -42.59 18.36 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.614 HG12 ' HA ' ' B' ' 593' ' ' LEU . 1.0 OUTLIER -52.39 -26.79 9.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.224 0.535 . . . . 0.0 111.504 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.624 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 14.3 tp -74.62 -81.07 0.07 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.426 -0.807 . . . . 0.0 112.492 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.624 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -140.37 29.7 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.105 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.617 -177.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.47 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 11.9 mtp-105 -142.22 38.94 1.58 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.274 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 23.7 m . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.131 -179.993 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.794 0.33 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.1 161.04 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.063 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.9 134.06 55.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.794 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.5 ' CG2' ' CG ' ' A' ' 477' ' ' PHE . 2.7 t -78.99 112.01 16.53 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.025 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 31.4 p -131.91 173.32 11.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.663 0.744 . . . . 0.0 112.605 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.559 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 13.3 mt-10 -69.03 -52.53 27.67 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.574 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -27.82 68.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.175 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . . . . . . . . . . . -65.16 -58.07 6.95 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.974 0.416 . . . . 0.0 111.174 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.506 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 21.7 t -52.29 -25.57 7.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.621 -179.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.2 mmm-85 -62.95 -41.8 99.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.927 0.394 . . . . 0.0 110.468 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -23.92 67.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.597 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.519 ' O ' ' O ' ' A' ' 466' ' ' LYS . 14.7 m-30 -76.04 -44.05 41.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.775 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.553 ' CD1' ' HB3' ' A' ' 500' ' ' LEU . 1.1 mt -65.98 -59.67 3.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.748 0.309 . . . . 0.0 111.328 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -26.21 4.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.039 0.447 . . . . 0.0 110.358 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -88.8 -42.46 11.89 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.724 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.519 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -172.54 161.62 4.07 Favored Pre-proline 0 CA--C 1.531 0.231 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.326 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.625 ' HB2' ' CD2' ' A' ' 512' ' ' HIS . 69.0 Cg_endo -73.3 173.03 14.43 Favored 'Trans proline' 0 N--CA 1.464 -0.252 0 C-N-CA 121.857 1.705 . . . . 0.0 112.91 -179.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.548 ' HG2' ' CG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -166.81 159.77 13.98 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-O 121.703 0.763 . . . . 0.0 112.613 -179.557 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.401 ' C ' HD13 ' A' ' 473' ' ' LEU . 9.2 p -113.51 155.8 24.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.559 -1.201 . . . . 0.0 108.333 177.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.74 -43.75 58.23 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.53 -178.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.587 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -60.86 -56.92 15.49 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.153 0.502 . . . . 0.0 109.973 179.016 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -56.78 -19.87 19.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.963 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.548 ' CG ' ' HG2' ' A' ' 468' ' ' MET . 5.9 mt -81.69 -37.89 26.68 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -179.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 471' ' ' LYS . 0.4 OUTLIER -84.05 -42.53 16.04 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -178.719 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 26.3 mmtm -47.21 -27.41 1.48 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.686 0.279 . . . . 0.0 111.612 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -87.33 -40.27 14.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.996 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.5 ' CG ' ' CG2' ' A' ' 454' ' ' VAL . 15.7 m-85 -74.94 -0.46 18.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -46.31 173.51 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.027 0.441 . . . . 0.0 111.775 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 36.9 p -55.01 -17.68 4.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.56 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 2.6 tmtm? -39.56 -32.11 0.12 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 8.2 mmmt -139.66 -63.77 0.5 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.631 0.253 . . . . 0.0 111.61 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' THR . . . . . . . . . . . . . 11.9 p -58.71 -8.85 1.43 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.353 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 61.31 21.19 59.48 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.659 -178.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 9.1 tp -94.9 125.22 39.41 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.072 -0.564 . . . . 0.0 111.395 -179.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.94 144.04 3.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.4 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 39.4 t -59.27 -20.03 50.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.786 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.41 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 9.7 mt-10 -94.61 -43.53 8.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.087 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -68.88 -40.75 79.05 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.184 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 41.4 m -50.87 -28.79 10.3 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 3.5 t -82.01 -41.96 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.395 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -59.52 -28.16 66.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.302 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.478 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 6.3 p -102.02 -6.95 9.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.019 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.502 ' HB2' ' O ' ' A' ' 489' ' ' THR . 10.2 tp -94.27 -44.77 7.8 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.801 0.334 . . . . 0.0 110.936 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -51.92 -38.1 55.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.207 -179.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.478 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -61.32 -40.08 92.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.185 -179.368 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.559 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 10.5 mt -74.95 -50.14 26.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.494 ' CD1' ' CD1' ' A' ' 473' ' ' LEU . 0.5 OUTLIER -32.2 -44.15 0.09 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -178.194 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.557 ' HA ' ' CD1' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -70.1 -38.16 75.59 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.551 ' HG3' ' HG2' ' A' ' 456' ' ' GLU . 1.4 mmm180 -58.79 -20.81 53.31 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.963 0.411 . . . . 0.0 110.578 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.553 ' HB3' ' CD1' ' A' ' 463' ' ' LEU . 67.4 mt -57.85 -47.58 82.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.86 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.553 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.7 t-20 60.58 58.85 3.92 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.143 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.553 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.0 Cg_endo -101.14 -162.71 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 124.168 3.245 . . . . 0.0 111.943 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.1 138.35 54.23 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.418 178.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.63 131.48 35.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.56 0.695 . . . . 0.0 112.104 -178.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.581 ' HE3' ' CE1' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -156.6 160.43 39.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.307 179.43 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.19 108.88 20.66 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.633 HG12 ' ND1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -89.62 110.81 22.18 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.52 178.185 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 64.28 42.53 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.154 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.3 t0 67.21 20.07 10.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.354 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.419 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.13 130.02 56.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.653 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 7.1 tpt -62.75 106.94 0.87 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.732 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.633 ' ND1' HG12 ' A' ' 507' ' ' ILE . 0.0 OUTLIER -124.55 156.15 37.84 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.883 -179.251 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.498 ' CE1' HD22 ' B' ' 597' ' ' LEU . 0.2 OUTLIER -133.21 122.42 23.94 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.674 177.733 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.624 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -177.76 169.33 2.07 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.064 0.459 . . . . 0.0 111.513 -179.456 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.52 ' CD2' ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -123.67 168.0 13.24 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.935 178.59 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.488 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -137.87 106.28 5.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.976 179.558 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.159 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.82 0.343 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -60.38 92.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.842 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . 0.409 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 3.6 t70 -90.12 49.62 1.73 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.923 0.392 . . . . 0.0 110.614 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.469 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 3.0 pp20? -86.21 -40.62 15.4 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.751 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.24 -22.83 30.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.579 -179.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -51.7 -55.19 20.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.094 0.473 . . . . 0.0 111.769 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.623 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.1 p-80 -78.69 -21.94 47.46 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.239 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.568 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 24.3 tp -58.83 -29.49 66.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.08 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 86.2 mt -85.96 -32.54 6.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.623 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.2 OUTLIER -71.71 -38.37 70.54 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.388 -0.525 . . . . 0.0 112.158 -178.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.659 ' O ' HG13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -70.58 -17.97 62.9 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.112 179.964 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' B' ' 599' ' ' ARG . 4.2 pt-20 -62.25 -30.68 71.29 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.739 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.494 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 1.5 pt-20 -82.82 -42.96 17.22 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -179.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.659 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.0 pp -52.48 -26.48 9.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.228 0.537 . . . . 0.0 110.816 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.649 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.4 tp -72.85 -82.27 0.05 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.249 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.649 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 31.2 m -141.31 29.72 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.052 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.757 -177.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.494 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 26.2 mtp180 -140.82 39.83 1.83 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.303 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.099 -179.992 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 2.5 p30 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.827 0.346 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 482' ' ' THR . 41.0 t -61.06 159.74 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.031 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -148.21 133.65 18.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.89 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.469 HG22 ' CD2' ' A' ' 477' ' ' PHE . 26.6 t -59.37 109.72 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.793 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 30.2 p -131.65 167.69 19.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.716 0.77 . . . . 0.0 112.479 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.454 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 22.1 mt-10 -62.94 -53.08 59.62 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.645 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -27.42 68.82 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.533 -178.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.448 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -66.66 -58.34 5.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.911 0.386 . . . . 0.0 111.238 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.506 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 16.9 t -49.76 -31.68 6.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.187 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.0 OUTLIER -55.54 -47.31 76.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.396 178.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -60.73 -26.79 67.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.939 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.506 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 4.3 m-30 -73.35 -45.35 55.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.048 0.451 . . . . 0.0 110.314 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.495 ' HB2' HD22 ' A' ' 515' ' ' LEU . 2.5 mt -67.2 -58.46 4.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.842 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.11 -23.84 6.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.908 0.385 . . . . 0.0 110.924 -179.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 -93.44 -44.24 8.35 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.308 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.435 ' HE2' ' HG2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -168.15 134.02 1.59 Allowed Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.005 -179.761 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.533 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 30.6 Cg_endo -60.94 142.11 96.57 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.244 1.963 . . . . 0.0 112.607 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.425 ' HE1' ' O ' ' A' ' 513' ' ' PHE . 0.0 OUTLIER -128.07 178.74 6.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.329 -179.422 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.418 HG23 ' CE1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -119.34 154.26 33.85 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 177.369 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.488 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -51.24 -44.66 61.75 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.04 -0.664 . . . . 0.0 110.839 -179.34 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.571 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -65.6 -54.8 22.72 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.484 178.514 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -58.65 -21.16 53.33 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.704 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.608 HD13 HD11 ' A' ' 497' ' ' LEU . 0.4 OUTLIER -80.14 -40.65 26.95 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 121.106 0.479 . . . . 0.0 111.628 -179.606 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.499 ' HA ' HD13 ' A' ' 493' ' ' LEU . 0.9 OUTLIER -83.8 -48.53 9.98 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.58 -178.968 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 29.9 mmtp -48.8 -26.72 2.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.693 0.282 . . . . 0.0 111.667 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.423 ' HE2' ' CE2' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -78.84 -36.16 42.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.1 179.869 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.469 ' CD2' HG22 ' A' ' 454' ' ' VAL . 11.5 m-85 -67.24 -52.86 35.78 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.371 0.605 . . . . 0.0 111.009 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . 0.4 ' HB3' ' HA ' ' A' ' 486' ' ' SER . 0.0 OUTLIER -57.03 130.23 45.19 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.19 -179.362 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 74.78 3.2 4.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.82 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 11.6 tptp -83.32 -54.74 4.77 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.818 0.342 . . . . 0.0 110.892 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -177.78 -34.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.097 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' THR . . . . . 0.41 ' HA ' ' O ' ' A' ' 452' ' ' VAL . 11.9 p -55.14 -19.47 7.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.974 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 68.7 18.62 72.34 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.936 -179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 4.7 mp -94.97 126.42 40.3 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.018 0.437 . . . . 0.0 111.352 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.42 154.7 1.7 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.581 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' SER . . . . . 0.4 ' HA ' ' HB3' ' A' ' 478' ' ' GLN . 53.2 p -62.31 -23.54 66.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.019 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.457 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 14.8 mt-10 -87.44 -51.97 5.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.558 179.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -62.02 -41.79 98.46 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.353 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.568 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 62.0 m -49.13 -39.69 29.53 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . 0.406 ' CG1' ' HG ' ' B' ' 593' ' ' LEU . 2.3 t -66.42 -49.96 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.385 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.01 -28.36 9.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.762 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.546 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.1 p -102.04 -13.8 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.011 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.568 ' HB2' ' O ' ' A' ' 489' ' ' THR . 0.4 OUTLIER -89.49 -41.19 12.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 120.751 0.31 . . . . 0.0 110.841 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.443 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -50.52 -41.2 53.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.08 0.467 . . . . 0.0 110.774 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.546 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -65.85 -40.06 91.37 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.375 -179.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.452 HG13 ' NE2' ' A' ' 495' ' ' GLN . 8.4 mt -75.84 -39.17 37.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.914 -179.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.608 HD11 HD13 ' A' ' 473' ' ' LEU . 2.4 mm? -42.95 -60.34 1.66 Allowed 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -178.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.531 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.79 -28.76 67.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.862 0.363 . . . . 0.0 111.522 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -27.07 66.08 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.172 0.51 . . . . 0.0 110.609 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.41 HD23 ' CD ' ' A' ' 460' ' ' ARG . 45.0 mt -60.58 -47.41 86.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.744 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.568 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.2 t-20 57.22 58.25 7.8 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.743 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.568 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 78.7 Cg_endo -101.31 -159.63 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.428 0 C-N-CA 124.039 3.159 . . . . 0.0 111.504 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.0 141.8 48.07 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.927 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 4.3 ppt_? -79.58 135.32 36.57 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.293 0.568 . . . . 0.0 111.315 -179.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.4 mtmt -155.57 134.65 12.17 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.698 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' MET . . . . . 0.424 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 12.4 ptm -82.83 110.43 17.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.013 0.435 . . . . 0.0 111.636 -179.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.464 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.68 111.0 22.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.748 178.973 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 58.9 t30 60.4 38.72 19.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.913 0.387 . . . . 0.0 110.464 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 3.5 t0 78.58 11.79 1.62 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.408 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.442 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.26 125.48 52.26 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.694 0.283 . . . . 0.0 111.271 179.83 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.47 109.07 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.987 0.422 . . . . 0.0 110.954 179.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.464 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 9.2 m80 -120.43 138.72 53.63 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.722 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.556 ' CD2' ' CD2' ' B' ' 597' ' ' LEU . 0.0 OUTLIER -107.49 124.17 49.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.279 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.533 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.6 OUTLIER -170.34 169.36 7.63 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.606 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.1 pt? -128.9 169.02 15.13 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.893 -1.048 . . . . 0.0 108.997 178.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.67 106.54 8.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.017 0.437 . . . . 0.0 111.289 179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.251 -0.88 . . . . 0.0 111.02 -179.959 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.826 0.346 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.28 87.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.847 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -90.12 49.8 1.76 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.956 0.408 . . . . 0.0 110.699 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.579 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.6 pt-20 -86.0 -48.66 8.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.638 179.381 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' B' ' 590' ' ' LEU . 0.4 OUTLIER -53.5 -22.34 7.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.565 -179.875 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -50.86 -44.65 59.64 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.921 0.391 . . . . 0.0 111.331 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.579 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.9 p-80 -80.31 -21.93 42.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.577 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.526 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 24.6 tp -55.86 -31.74 63.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.998 0.428 . . . . 0.0 110.861 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.1 mt -85.91 -29.53 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.998 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.544 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.77 -39.81 91.39 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.634 -179.436 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.544 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -78.63 -18.58 54.28 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.084 0.468 . . . . 0.0 110.037 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -63.53 -34.19 77.25 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.445 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.424 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 6.5 pt-20 -76.68 -44.7 32.6 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -178.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.512 HG12 ' HA ' ' B' ' 593' ' ' LEU . 2.9 pt -50.66 -26.87 4.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 121.158 0.504 . . . . 0.0 111.789 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.629 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.9 tp -75.36 -80.67 0.08 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.43 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.629 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -141.89 30.9 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.116 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.602 -177.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.424 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 25.4 mtp85 -142.31 41.84 1.63 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.437 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 8.8 m . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.081 179.958 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.854 0.359 . . . . 0.0 111.299 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . 0.409 ' O ' ' HA ' ' A' ' 482' ' ' THR . 8.1 p -171.69 159.77 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.061 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -149.98 135.61 18.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.843 0.354 . . . . 0.0 110.953 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.43 HG23 ' CD2' ' A' ' 477' ' ' PHE . 12.5 t -68.59 112.74 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.332 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' THR . . . . . 0.4 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.8 p -131.78 165.97 22.59 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.607 0.717 . . . . 0.0 112.485 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.565 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 16.9 mt-10 -61.24 -53.74 53.01 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.54 179.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.49 -28.07 65.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.206 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . . . . . . . . . . . -74.1 -38.26 63.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.701 -179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' A' ' 463' ' ' LEU . 15.7 t -70.59 -37.92 71.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.206 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.565 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 2.0 mmm-85 -52.54 -54.82 27.61 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.452 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -56.45 -27.46 56.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.85 179.497 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.468 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 17.5 m-30 -73.52 -46.96 44.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.13 179.091 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.512 HD11 ' HB3' ' A' ' 500' ' ' LEU . 2.1 mt -65.79 -57.44 7.97 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.407 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -48.27 -27.54 2.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.11 0.481 . . . . 0.0 110.421 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.494 ' O ' ' HG2' ' A' ' 466' ' ' LYS . 10.8 ttt85 -88.58 -54.08 4.34 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.648 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.53 ' HD3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -158.81 152.13 18.84 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.974 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.542 ' HB2' ' HB3' ' A' ' 512' ' ' HIS . 80.9 Cg_endo -72.97 175.86 9.85 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.619 2.213 . . . . 0.0 112.94 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.634 ' HG3' ' CD2' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -168.46 166.25 12.28 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.204 0.526 . . . . 0.0 112.044 -178.719 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.551 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 4.1 p -105.36 154.97 19.57 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 177.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.457 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.0 OUTLIER -55.64 -33.71 64.29 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.141 -179.564 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.42 ' HB3' HD23 ' B' ' 590' ' ' LEU . 0.1 OUTLIER -69.38 -52.03 31.02 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.309 0.576 . . . . 0.0 109.463 178.9 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -58.82 -31.13 68.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.378 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.634 ' CD2' ' HG3' ' A' ' 468' ' ' MET . 3.2 mt -64.7 -48.58 74.15 Favored 'General case' 0 CA--C 1.522 -0.099 0 CA-C-O 120.939 0.399 . . . . 0.0 111.271 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.435 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 0.8 OUTLIER -79.67 -32.09 41.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.956 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.401 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -58.73 -26.83 64.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.175 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -86.28 -43.05 13.24 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.587 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.465 ' CE2' ' HE2' ' A' ' 476' ' ' LYS . 12.8 m-85 -67.4 -68.76 0.36 Allowed 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.488 0.661 . . . . 0.0 110.192 179.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.27 174.44 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.594 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 12.7 t -73.04 -6.27 44.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.349 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -45.48 -29.21 1.07 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.782 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -136.87 -57.77 0.72 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.089 -0.244 . . . . 0.0 111.509 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' ' 452' ' ' VAL . 19.1 p -53.66 -14.46 0.89 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.239 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 65.48 18.36 65.51 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.373 -0.918 . . . . 0.0 111.066 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 3.3 mp -106.83 121.43 44.38 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 120.914 0.388 . . . . 0.0 111.277 -179.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -41.37 152.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.913 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 p -61.56 -24.72 66.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.07 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -84.36 -53.51 5.41 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.531 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -59.93 -43.46 94.92 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.034 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.41 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 54.9 m -47.78 -32.26 5.79 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-O 121.194 0.521 . . . . 0.0 109.704 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 3.9 t -75.62 -45.47 38.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.04 178.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -56.51 -27.36 57.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.118 179.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.528 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 8.3 p -102.11 -12.77 8.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.087 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.462 ' CD1' ' CD2' ' A' ' 497' ' ' LEU . 10.2 tp -89.39 -41.3 12.19 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.786 0.327 . . . . 0.0 110.913 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.58 ' O ' ' NZ ' ' A' ' 498' ' ' LYS . . . -53.99 -41.04 67.48 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.013 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.7 OUTLIER -57.17 -41.37 79.13 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.432 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.534 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 8.8 mt -79.84 -31.2 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -177.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.462 ' CD2' ' CD1' ' A' ' 493' ' ' LEU . 1.7 mm? -51.07 -50.29 58.98 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -178.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.58 ' NZ ' ' O ' ' A' ' 494' ' ' ALA . 0.0 OUTLIER -69.44 -24.26 63.79 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -177.875 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.482 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 10.5 mmm-85 -61.94 -19.58 62.88 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.226 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.512 ' HB3' HD11 ' A' ' 463' ' ' LEU . 23.1 mt -66.08 -47.68 73.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.26 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.549 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.5 t-20 56.96 59.37 7.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.547 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.549 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 84.4 Cg_endo -101.02 -157.96 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.375 0 C-N-CA 123.918 3.079 . . . . 0.0 111.465 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.08 139.66 53.02 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.082 179.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.62 135.75 36.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.258 0.551 . . . . 0.0 111.478 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -154.72 160.08 41.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.733 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -104.97 108.9 20.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.902 0.382 . . . . 0.0 111.691 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.471 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.92 110.82 22.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.067 178.951 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 58.88 44.22 16.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.056 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.1 t70 74.32 8.1 4.57 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.47 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.45 ' O ' ' N ' ' A' ' 507' ' ' ILE . 1.5 tpmt? -113.48 130.79 56.25 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-O 120.651 0.262 . . . . 0.0 110.754 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 5.4 tpt -67.54 108.69 2.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.051 0.453 . . . . 0.0 110.994 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.551 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 12.0 m170 -122.45 138.17 54.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.632 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.496 ' CE2' ' CD2' ' B' ' 597' ' ' LEU . 0.0 OUTLIER -105.15 133.2 50.31 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.53 ' HB2' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -176.87 169.24 2.46 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.918 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.602 ' N ' HD21 ' A' ' 515' ' ' LEU . 1.3 pt? -129.76 168.9 15.84 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.196 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.12 106.48 7.64 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.01 0.434 . . . . 0.0 111.438 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.827 179.926 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.693 0.282 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -66.32 76.42 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.957 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -90.17 49.69 1.74 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.903 0.382 . . . . 0.0 110.795 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.577 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 3.0 pp20? -86.25 -45.75 10.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.725 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.39 -22.23 7.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.752 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 -50.48 -45.77 56.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.93 0.395 . . . . 0.0 111.354 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.701 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.9 p-80 -80.29 -21.88 42.18 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.351 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.543 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 24.7 tp -64.99 -28.99 69.89 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.324 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 77.9 mt -85.51 -32.71 7.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.701 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.58 -39.29 70.66 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.464 -0.495 . . . . 0.0 111.837 -179.243 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.656 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -70.72 -17.9 62.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.202 0.525 . . . . 0.0 110.081 -179.822 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.447 ' HA ' HG21 ' A' ' 470' ' ' THR . 3.8 pt-20 -63.21 -30.8 71.87 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.012 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.462 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 2.7 pt-20 -83.01 -43.0 16.86 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.642 HG13 ' O ' ' B' ' 593' ' ' LEU . 1.9 pp -52.22 -26.59 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.196 0.522 . . . . 0.0 110.935 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.679 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 11.8 tp -69.56 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.336 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.679 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -144.24 30.72 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 CA-C-N 114.693 -1.139 . . . . 0.0 110.575 -178.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.462 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 54.9 mtp180 -138.68 43.68 2.1 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.141 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 30.1 m . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.137 179.989 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.828 0.347 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . 0.646 ' CG2' ' H ' ' A' ' 453' ' ' GLN . 8.7 p -62.99 -147.16 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.356 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . 0.646 ' H ' ' CG2' ' A' ' 452' ' ' VAL . 2.1 mm-40 91.26 114.61 0.03 OUTLIER 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 124.236 1.015 . . . . 0.0 109.078 -178.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.419 HG21 ' CD2' ' A' ' 477' ' ' PHE . 19.3 t -57.72 117.93 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.674 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 26.3 p -131.55 173.39 11.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.644 0.735 . . . . 0.0 112.66 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.583 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 15.1 mt-10 -68.04 -53.07 28.5 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.385 179.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.83 -28.8 62.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.192 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -70.04 -58.24 4.05 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.748 0.309 . . . . 0.0 111.347 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.494 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 19.2 t -51.75 -26.31 6.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.759 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.583 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.3 mmm-85 -63.09 -44.42 95.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.804 0.335 . . . . 0.0 110.336 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -61.74 -24.98 67.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.504 179.684 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.494 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 4.0 m-30 -71.61 -46.37 59.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.998 0.428 . . . . 0.0 110.153 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.537 ' CB ' HD13 ' A' ' 515' ' ' LEU . 0.4 OUTLIER -65.91 -58.29 5.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.479 -179.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -23.92 2.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.932 0.396 . . . . 0.0 110.599 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.5 mtt85 -94.11 -42.67 8.87 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.417 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.457 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -173.36 156.28 2.85 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 120.766 0.317 . . . . 0.0 111.27 -179.737 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.662 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 71.8 Cg_endo -73.62 147.3 40.21 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.743 2.295 . . . . 0.0 113.463 -179.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.454 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -143.35 149.58 37.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.846 -179.702 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.458 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 12.1 p -90.14 177.37 6.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 176.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.447 HG21 ' HA ' ' B' ' 594' ' ' GLU . 0.5 OUTLIER -70.97 -34.96 71.92 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.147 -0.621 . . . . 0.0 111.06 -179.735 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.414 ' HG2' ' CD2' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -72.48 -49.5 32.69 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.661 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -60.77 -34.49 74.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.691 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.454 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 0.9 OUTLIER -64.19 -42.22 96.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.973 0.416 . . . . 0.0 110.9 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.478 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 3.0 pp -84.13 -33.06 24.37 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.741 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.06 -26.83 2.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.617 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.45 ' CE ' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -86.09 -43.63 12.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.492 -179.825 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.45 ' CD2' ' CE ' ' A' ' 476' ' ' LYS . 5.4 m-85 -61.29 -40.16 93.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.112 0.482 . . . . 0.0 111.406 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -57.58 116.74 3.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.149 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 75.27 3.28 4.03 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.893 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.81 -54.41 6.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.881 0.372 . . . . 0.0 110.911 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? 177.1 -27.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.21 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' THR . . . . . 0.419 ' HA ' HG13 ' A' ' 452' ' ' VAL . 0.0 OUTLIER -47.03 -25.39 0.81 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.863 0.363 . . . . 0.0 111.079 179.532 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 66.65 15.19 63.83 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.653 -0.785 . . . . 0.0 111.856 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.415 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 1.1 mp -95.59 127.54 41.71 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.016 0.436 . . . . 0.0 111.028 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.78 155.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.709 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.5 m -60.63 -22.64 64.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.129 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.457 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 8.6 mt-10 -91.23 -44.93 8.92 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.61 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . 0.431 ' HA ' ' HB3' ' A' ' 491' ' ' ASN . 2.2 mt-30 -65.41 -40.62 93.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.115 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 70.2 m -51.02 -28.57 10.4 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.21 0.529 . . . . 0.0 109.595 178.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 14.4 t -84.97 -41.64 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.831 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . 0.431 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 7.1 t30 -60.96 -29.22 69.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.025 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.521 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.3 p -98.6 -7.25 9.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.924 179.477 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.498 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 39.2 tp -94.61 -46.89 6.76 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 121.029 0.442 . . . . 0.0 110.714 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.47 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -49.74 -34.12 18.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.401 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.7 OUTLIER -68.35 -44.07 76.09 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.72 -179.493 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.527 ' HA ' ' HG2' ' A' ' 499' ' ' ARG . 9.5 mt -79.39 -32.64 14.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.498 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.0 OUTLIER -44.12 -56.99 3.65 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.589 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.46 ' H ' ' HD2' ' A' ' 498' ' ' LYS . 0.0 OUTLIER -59.9 -33.36 71.75 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -178.097 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.527 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 14.3 mmm180 -56.64 -22.18 32.44 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.981 0.42 . . . . 0.0 110.814 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.501 ' HB3' HD12 ' A' ' 463' ' ' LEU . 93.6 mt -59.64 -47.6 84.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.171 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.589 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.0 t-20 58.36 57.48 6.41 Favored Pre-proline 0 C--N 1.32 -0.716 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.311 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.589 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 56.5 Cg_endo -99.84 -159.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 124.137 3.225 . . . . 0.0 111.363 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.8 139.78 52.65 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.771 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 5.3 ptt-85 -79.64 133.44 36.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.488 0.661 . . . . 0.0 111.5 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -156.25 160.21 39.58 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.664 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -103.86 110.39 22.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.995 0.426 . . . . 0.0 111.502 -179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.462 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.64 110.86 22.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.942 179.085 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.3 t30 59.8 43.13 15.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.841 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 73.28 12.36 4.85 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.35 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.418 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -116.1 131.38 56.96 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.866 179.826 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 28.9 mmm -62.9 108.49 1.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.061 0.457 . . . . 0.0 110.552 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.462 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 23.7 m80 -122.76 125.52 45.65 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.081 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.512 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -104.92 123.37 47.63 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 178.71 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.662 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER 179.43 169.37 1.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.08 0.467 . . . . 0.0 111.33 -178.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.537 HD13 ' CB ' ' A' ' 463' ' ' LEU . 0.0 OUTLIER -118.78 168.7 10.5 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.641 178.547 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.495 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -136.9 106.05 6.0 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.082 0.467 . . . . 0.0 111.219 179.54 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.087 179.958 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.838 0.352 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.18 94.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.935 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -87.05 49.08 1.75 Allowed 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 120.906 0.384 . . . . 0.0 110.741 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.469 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.7 pt-20 -86.54 -34.74 19.87 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.371 0.605 . . . . 0.0 110.288 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -84.25 -22.92 30.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.541 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -56.15 -55.25 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.083 0.468 . . . . 0.0 111.699 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.676 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.5 p-80 -76.57 -21.97 54.93 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.319 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.56 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 19.5 tp -61.06 -29.32 69.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.452 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 82.6 mt -85.92 -34.4 8.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.676 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.4 OUTLIER -71.53 -40.74 69.87 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 120.51 -0.476 . . . . 0.0 112.163 -178.812 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.666 ' O ' HG13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -65.4 -18.62 65.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.211 0.529 . . . . 0.0 110.052 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.468 ' HA ' HG22 ' A' ' 470' ' ' THR . 14.3 tt0 -63.62 -30.41 71.52 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.551 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.628 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.5 OUTLIER -77.52 -48.05 18.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.241 -178.945 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.666 HG13 ' O ' ' B' ' 593' ' ' LEU . 1.6 pp -51.16 -26.68 5.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.103 0.478 . . . . 0.0 110.94 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.628 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 14.2 tp -62.48 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.541 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.628 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 34.9 m -136.1 37.13 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.06 0 CA-C-N 114.877 -1.056 . . . . 0.0 111.245 -177.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.628 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 17.3 mtp180 -129.71 102.05 6.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.062 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 28.2 m . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.211 179.877 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.849 0.357 . . . . 0.0 111.296 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . 0.408 ' O ' ' HA ' ' A' ' 482' ' ' THR . 7.2 p -173.45 144.29 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.984 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -124.13 135.34 53.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.813 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.426 HG23 ' CD2' ' A' ' 477' ' ' PHE . 2.1 t -60.3 116.85 1.94 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.802 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' THR . . . . . 0.422 ' O ' HG21 ' A' ' 459' ' ' VAL . 28.2 p -131.65 167.97 18.54 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.585 0.707 . . . . 0.0 112.533 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.534 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 17.7 mt-10 -65.1 -54.87 23.33 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.188 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -50.59 -28.39 8.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.654 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.412 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -76.92 -35.83 57.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.762 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.45 HG21 HG21 ' A' ' 496' ' ' ILE . 13.2 t -76.1 -31.89 22.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.709 0.29 . . . . 0.0 111.446 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.534 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.1 mmm180 -61.43 -41.24 96.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.211 179.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.454 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -65.81 -29.01 69.42 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.407 179.275 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.454 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 11.4 m-30 -64.3 -45.74 86.66 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.637 HD13 ' HB3' ' A' ' 500' ' ' LEU . 0.4 OUTLIER -64.56 -59.05 4.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.876 179.534 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.82 -26.6 1.7 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.234 179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -88.89 -49.32 6.87 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.809 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.423 ' HD3' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -171.78 162.81 4.72 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.114 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.553 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 97.4 Cg_endo -80.37 160.08 22.82 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.763 2.309 . . . . 0.0 113.292 -179.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.449 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -157.21 168.2 28.11 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.369 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.497 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 4.6 p -100.75 176.1 5.42 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 176.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.468 HG22 ' HA ' ' B' ' 594' ' ' GLU . 0.1 OUTLIER -71.33 -30.85 66.69 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 119.992 -0.683 . . . . 0.0 111.401 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.547 ' HD2' ' H ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -77.17 -50.17 13.56 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.569 0.699 . . . . 0.0 109.388 178.53 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -57.91 -31.4 66.73 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.12 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.449 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 0.9 OUTLIER -70.49 -39.22 74.31 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-O 120.989 0.423 . . . . 0.0 110.664 179.852 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.556 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 2.1 pp -84.2 -33.15 24.22 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.938 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.42 -27.67 1.79 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.372 -179.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.432 ' HE2' ' CE2' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -85.35 -43.08 13.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.171 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.429 ' CD2' ' HE3' ' A' ' 476' ' ' LYS . 10.0 m-85 -64.38 -42.04 96.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.109 0.48 . . . . 0.0 111.26 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -54.06 113.99 1.44 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.042 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 76.75 3.18 3.42 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.495 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -64.55 -54.19 36.02 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.815 0.341 . . . . 0.0 110.876 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.14 -30.1 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.255 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' THR . . . . . 0.408 ' HA ' ' O ' ' A' ' 452' ' ' VAL . 8.1 p -50.96 -21.91 2.0 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.041 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 65.45 16.31 62.73 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.815 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -86.05 130.05 34.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 120.937 0.398 . . . . 0.0 111.131 -179.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -43.9 149.93 0.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.669 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.76 -21.65 61.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.467 179.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.439 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 12.6 mt-10 -91.59 -49.17 6.44 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.716 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -62.57 -42.09 99.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.31 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 87.1 m -49.11 -29.6 5.47 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.246 0.546 . . . . 0.0 109.692 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . 0.408 ' CG1' ' HG ' ' B' ' 593' ' ' LEU . 13.7 t -83.12 -41.99 17.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.061 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -59.81 -31.97 70.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.063 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.505 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.6 p -94.86 -11.62 8.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.825 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.57 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 11.5 tp -90.22 -44.89 9.44 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.926 0.393 . . . . 0.0 110.777 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.512 ' HB2' ' HB2' ' B' ' 593' ' ' LEU . . . -50.76 -33.9 25.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.569 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.505 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -67.81 -40.56 83.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.789 -179.279 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.5 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 8.7 mt -77.99 -43.42 28.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.57 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.2 OUTLIER -37.77 -56.24 1.1 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -178.466 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.476 ' H ' ' HD2' ' A' ' 498' ' ' LYS . 0.0 OUTLIER -59.78 -23.56 63.38 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.557 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.454 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 0.1 OUTLIER -64.74 -18.53 65.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.137 0.494 . . . . 0.0 110.204 179.114 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.637 ' HB3' HD13 ' A' ' 463' ' ' LEU . 29.9 mt -59.7 -47.59 85.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.104 -179.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.639 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.8 t-20 56.63 54.99 8.24 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.287 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.639 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.2 Cg_endo -101.41 -160.27 0.04 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 124.249 3.3 . . . . 0.0 111.67 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.75 141.29 48.76 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.658 178.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.64 133.55 36.4 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.4 0.619 . . . . 0.0 111.512 -178.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -156.29 160.18 39.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.007 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.12 109.78 21.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.866 0.365 . . . . 0.0 111.347 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.438 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -90.73 110.86 22.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.021 179.071 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 58.6 t30 58.88 44.91 15.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.804 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.2 t70 71.57 13.24 6.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.201 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -116.09 127.59 54.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.636 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.16 108.51 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.921 0.391 . . . . 0.0 110.438 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.497 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 9.0 m-70 -122.47 128.22 50.58 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.946 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.54 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -104.89 122.88 46.71 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.733 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.553 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER 179.25 169.33 1.01 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.069 0.461 . . . . 0.0 111.437 -178.757 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.552 HD12 ' CB ' ' A' ' 463' ' ' LEU . 0.0 OUTLIER -120.34 168.88 10.83 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.521 178.331 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.488 ' N ' HD23 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -134.01 106.15 7.09 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.136 0.494 . . . . 0.0 111.204 179.605 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.057 179.887 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.833 0.349 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.94 100.02 0.19 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.085 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . 0.524 ' O3P' ' CG2' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . 0.403 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 3.3 t70 -90.17 49.67 1.74 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 120.956 0.408 . . . . 0.0 110.617 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.443 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.2 pt-20 -86.13 -38.26 17.92 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.771 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.15 -22.68 33.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.597 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -50.93 -55.21 18.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.953 0.406 . . . . 0.0 111.719 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.46 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 0.5 OUTLIER -80.11 -21.9 42.75 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.164 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.64 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 39.7 tp -54.43 -47.6 72.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.004 0.43 . . . . 0.0 110.859 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 48.9 mt -86.24 -29.6 6.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.785 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.584 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.06 -45.46 77.29 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.387 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.64 ' CD1' ' O ' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -67.96 -20.34 65.05 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.172 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -63.44 -30.86 71.92 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.323 179.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.413 ' HA ' ' CB ' ' B' ' 599' ' ' ARG . 0.3 OUTLIER -70.83 -45.83 63.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.532 -179.537 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.497 ' CG1' ' O ' ' B' ' 593' ' ' LEU . 5.1 pt -58.14 -26.62 29.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.307 0.575 . . . . 0.0 110.678 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.637 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 12.2 tp -72.31 -81.74 0.05 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.1 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.637 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.7 m -141.76 30.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.059 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.593 -177.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.413 ' CB ' ' HA ' ' B' ' 595' ' ' GLU . 7.0 mtp180 -138.82 39.0 2.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.272 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.195 -0.907 . . . . 0.0 111.168 179.955 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.755 0.312 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . 0.407 ' CG1' HG23 ' A' ' 482' ' ' THR . 7.4 p -63.62 123.13 15.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.923 0.392 . . . . 0.0 111.148 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.46 133.42 53.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.195 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.457 ' CG2' ' CD2' ' A' ' 477' ' ' PHE . 2.2 t -63.92 121.86 13.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.382 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 35.0 p -131.49 170.71 14.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.689 0.757 . . . . 0.0 112.779 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.516 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 23.8 mt-10 -69.06 -52.97 22.98 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.328 -1.305 . . . . 0.0 110.73 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.92 -27.5 68.86 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.314 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.44 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -69.71 -36.71 76.15 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.458 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.52 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 15.6 t -70.67 -36.92 67.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.808 0.337 . . . . 0.0 110.911 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.423 ' CD ' HD22 ' A' ' 500' ' ' LEU . 1.5 mmm-85 -52.76 -49.56 65.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.953 178.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.504 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -61.66 -23.74 66.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.014 179.8 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.52 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 8.4 m-30 -75.17 -42.62 55.57 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.223 0.535 . . . . 0.0 109.605 178.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.475 HD12 ' CD2' ' A' ' 515' ' ' LEU . 1.8 mt -69.46 -57.66 4.97 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.454 -179.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -48.28 -27.58 2.58 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.091 0.472 . . . . 0.0 110.364 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.645 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 15.2 mtt180 -83.96 -55.75 4.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.517 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.645 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER -163.72 146.37 7.78 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.657 -179.936 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.593 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 43.9 Cg_endo -68.1 161.52 44.05 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.64 2.227 . . . . 0.0 113.139 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.536 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -159.64 166.61 30.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.567 -179.227 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.488 HG22 ' CD2' ' A' ' 512' ' ' HIS . 51.8 p -98.73 178.56 4.94 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.19 -40.74 71.02 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.612 179.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.52 ' H ' ' CD ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -64.47 -52.2 59.19 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.264 0.554 . . . . 0.0 109.852 179.013 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . 0.426 ' H ' ' HG2' ' A' ' 471' ' ' LYS . 46.3 t0 -59.94 -25.04 64.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.621 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.536 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 1.4 tt -86.13 -45.47 11.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.004 0.431 . . . . 0.0 111.616 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.482 ' HA ' ' CD2' ' A' ' 493' ' ' LEU . 3.6 pp -76.09 -44.1 40.36 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.087 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 471' ' ' LYS . 0.1 OUTLIER -52.34 -24.27 7.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.681 0.277 . . . . 0.0 111.204 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.587 ' HG2' ' N ' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -76.99 -44.43 31.09 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.521 -179.424 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.587 ' N ' ' HG2' ' A' ' 476' ' ' LYS . 9.1 m-85 -60.6 -48.41 81.92 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.593 0.711 . . . . 0.0 109.753 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . 0.492 ' O ' ' O ' ' A' ' 477' ' ' PHE . 3.2 mm-40 44.17 174.93 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.496 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 1.3 m -80.3 3.07 22.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.272 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.59 -58.05 3.71 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -118.84 -44.5 2.62 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -179.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' THR . . . . . 0.407 HG23 ' CG1' ' A' ' 452' ' ' VAL . 16.2 p -51.51 -18.23 1.03 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.238 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 63.69 18.97 62.3 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.51 -0.853 . . . . 0.0 111.266 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.408 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 5.0 mp -107.04 122.67 46.92 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.963 0.411 . . . . 0.0 111.116 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.66 158.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.704 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 14.7 m -60.84 -27.2 67.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.127 0.489 . . . . 0.0 110.089 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.46 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 4.3 mt-10 -86.95 -46.63 9.69 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.415 179.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -63.2 -40.34 97.21 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.0 179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.446 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 96.7 m -50.71 -28.07 8.32 Favored 'General case' 0 C--N 1.335 -0.058 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 4.6 t -82.05 -44.16 19.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.107 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -56.31 -25.85 50.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.754 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.51 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 6.9 p -100.31 -14.17 7.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.546 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.482 ' CD2' ' HA ' ' A' ' 474' ' ' LEU . 0.2 OUTLIER -91.0 -35.22 14.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.888 0.375 . . . . 0.0 110.91 -179.776 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.49 ' HB1' HD12 ' B' ' 596' ' ' ILE . . . -58.33 -38.54 77.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.273 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.6 OUTLIER -63.13 -40.83 98.72 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.424 -179.614 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.516 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 8.3 mt -79.02 -44.31 24.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.569 -178.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.463 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 2.3 mm? -41.15 -50.91 3.5 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.526 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -64.26 -33.17 75.21 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.873 0.368 . . . . 0.0 111.948 -178.768 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.465 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 0.7 OUTLIER -55.9 -23.3 30.53 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.003 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.434 ' HB3' HD13 ' A' ' 463' ' ' LEU . 56.8 mt -59.99 -47.54 85.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.924 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.539 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 24.9 t-20 58.13 59.94 6.18 Favored Pre-proline 0 C--N 1.32 -0.715 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.503 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.539 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 84.7 Cg_endo -101.06 -157.29 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.306 0 C-N-CA 123.966 3.111 . . . . 0.0 111.419 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.01 140.44 51.91 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.012 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.8 135.14 36.41 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.337 0.589 . . . . 0.0 111.579 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 14.7 mtmt -156.11 159.26 38.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.587 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' MET . . . . . 0.407 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -105.17 111.65 24.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.031 0.443 . . . . 0.0 111.722 -179.64 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.531 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.89 110.94 22.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.001 179.0 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 9.4 t30 58.62 42.96 19.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.836 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 74.45 12.38 3.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.391 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 506' ' ' MET . 0.0 OUTLIER -116.17 130.96 57.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.854 179.824 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.97 109.1 1.68 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.962 0.41 . . . . 0.0 111.022 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.488 ' CD2' HG22 ' A' ' 469' ' ' THR . 11.1 m170 -122.31 138.21 54.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.886 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.504 ' CE2' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -111.13 128.33 55.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.114 179.408 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.593 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -179.89 169.24 1.28 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.239 0.542 . . . . 0.0 112.16 -179.097 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.531 HD22 ' N ' ' A' ' 515' ' ' LEU . 1.2 pt? -122.03 169.19 11.08 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.206 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.6 106.62 8.3 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.418 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.107 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.837 0.351 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.4 86.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.988 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -90.03 49.46 1.71 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 120.968 0.414 . . . . 0.0 110.737 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.473 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 11.9 pt-20 -86.19 -40.82 15.23 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.711 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.45 -22.75 30.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.617 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -52.06 -55.26 21.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.744 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.694 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.2 p-80 -77.63 -21.86 51.61 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.251 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.529 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 23.4 tp -61.93 -29.46 70.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.344 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . 0.425 HG21 HD12 ' B' ' 591' ' ' ILE . 76.0 mt -85.97 -34.64 8.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.694 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.67 -43.54 65.84 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 120.346 -0.542 . . . . 0.0 112.065 -179.018 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.683 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -64.08 -18.85 64.79 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.166 -179.656 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' B' ' 599' ' ' ARG . 3.7 pt-20 -63.55 -30.74 71.81 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.432 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.3 OUTLIER -74.8 -48.48 25.14 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.97 -179.357 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.625 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.1 pp -53.72 -26.52 13.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.275 0.559 . . . . 0.0 110.721 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.64 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.1 tp -71.85 -82.44 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.969 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.64 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.4 m -141.66 30.53 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.76 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.432 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.2 OUTLIER -139.17 37.99 2.11 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.396 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 9.4 p . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.052 179.843 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.911 0.386 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 39.5 t -60.07 158.85 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.141 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.92 132.33 15.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.696 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.431 HG23 ' CD2' ' A' ' 477' ' ' PHE . 3.9 t -79.99 110.33 15.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.693 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 32.5 p -131.77 168.14 18.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.68 0.752 . . . . 0.0 112.578 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.483 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 20.9 mt-10 -61.59 -53.33 57.65 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.359 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.12 -27.86 69.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.237 -179.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.438 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -68.54 -35.81 77.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.363 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.478 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 19.0 t -73.52 -35.38 44.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.903 0.383 . . . . 0.0 110.865 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.432 ' CD ' HD23 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -52.98 -51.36 61.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.816 178.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.501 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -56.15 -30.33 62.02 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.794 179.693 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.501 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 11.0 m-30 -71.25 -41.71 69.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.081 0.467 . . . . 0.0 110.205 179.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.454 HD11 ' CD2' ' A' ' 515' ' ' LEU . 1.9 mt -70.8 -58.96 3.09 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.446 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -48.56 -27.75 2.97 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.048 0.451 . . . . 0.0 110.756 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -85.91 -52.14 5.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.887 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -166.48 130.49 1.62 Allowed Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.904 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.56 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 12.2 Cg_endo -55.0 160.76 7.42 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.62 2.213 . . . . 0.0 112.708 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.456 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -154.23 178.0 10.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.457 0.646 . . . . 0.0 111.718 -179.156 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.529 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 1.3 p -111.24 159.54 17.81 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.424 HG21 HD22 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -53.9 -48.09 70.49 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.539 -179.929 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.475 ' HG2' ' CD2' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -56.98 -53.45 57.88 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.251 179.555 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -62.65 -33.47 75.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.727 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.456 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 1.3 tt -70.53 -41.65 72.29 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 121.093 0.473 . . . . 0.0 111.418 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.441 ' CD2' ' CD1' ' B' ' 590' ' ' LEU . 2.4 pp -84.19 -37.3 22.03 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.241 -179.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 471' ' ' LYS . 0.1 OUTLIER -52.07 -40.45 61.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.749 0.309 . . . . 0.0 111.219 -179.435 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.444 ' HE2' ' CE2' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -61.97 -41.68 98.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.138 -179.842 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.431 ' CD2' HG23 ' A' ' 454' ' ' VAL . 13.3 m-85 -65.95 -66.08 0.59 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.507 0.67 . . . . 0.0 110.464 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 52.11 174.28 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.323 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 11.7 t -74.06 -15.43 61.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.221 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.29 -8.25 53.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.572 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 46.7 mmtt -119.75 -73.9 0.63 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.73 0.3 . . . . 0.0 111.507 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' THR . . . . . . . . . . . . . 71.3 p -78.52 13.13 1.7 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.384 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 54.97 22.39 27.49 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.479 -0.867 . . . . 0.0 111.775 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -104.97 123.47 47.83 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 120.997 0.427 . . . . 0.0 111.337 -179.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.92 158.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.582 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 12.2 p -62.0 -25.03 67.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.971 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.435 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 18.6 mt-10 -89.0 -51.15 5.75 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.354 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -42.93 96.13 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.237 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 47.9 m -49.55 -37.69 28.14 Favored 'General case' 0 CA--C 1.522 -0.12 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 179.082 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 2.7 t -71.19 -46.75 64.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.065 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.79 -25.83 43.15 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.567 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.498 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 9.1 p -101.75 -14.48 8.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.541 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 489' ' ' THR . 0.1 OUTLIER -91.41 -35.74 14.2 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.968 0.414 . . . . 0.0 110.543 179.928 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.445 ' HB1' ' CD1' ' B' ' 596' ' ' ILE . . . -56.44 -37.01 69.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.092 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.498 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.38 -41.49 80.5 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.768 -179.473 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.483 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 10.2 mt -77.35 -39.37 27.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.094 -179.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.471 ' HB3' ' CD1' ' B' ' 597' ' ' LEU . 1.4 mm? -42.73 -59.26 2.0 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.516 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -60.04 -30.89 69.49 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -178.798 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.404 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 0.4 OUTLIER -56.52 -23.76 41.88 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.432 HD23 ' CD ' ' A' ' 460' ' ' ARG . 55.9 mt -61.43 -47.49 85.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.756 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.559 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 58.78 59.41 5.6 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.598 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.559 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 77.3 Cg_endo -101.22 -159.32 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.356 0 C-N-CA 123.996 3.131 . . . . 0.0 111.555 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.77 139.87 52.5 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.724 178.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -79.64 133.94 36.42 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.411 0.624 . . . . 0.0 111.592 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 19.2 mtmt -156.3 159.86 39.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.569 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -105.17 111.83 24.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.965 0.412 . . . . 0.0 111.656 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.473 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.79 110.92 22.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.976 178.995 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 58.73 42.87 19.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.818 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 74.58 12.76 3.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.353 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.22 129.25 56.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.681 0.276 . . . . 0.0 110.94 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 2.9 tpt -62.13 108.57 1.09 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.013 0.435 . . . . 0.0 110.643 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.529 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 10.8 m170 -122.64 126.98 48.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.137 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.489 ' CE2' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.08 123.75 48.5 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.902 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.56 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -178.94 169.51 1.57 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.158 0.504 . . . . 0.0 112.062 -178.598 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.469 ' N ' HD21 ' A' ' 515' ' ' LEU . 1.4 pt? -116.07 169.15 9.48 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.332 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.403 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -136.48 106.67 6.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.996 0.427 . . . . 0.0 111.429 179.706 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.151 179.992 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.82 0.343 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -64.38 81.0 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.965 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -90.09 48.99 1.64 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 120.99 0.424 . . . . 0.0 110.624 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.536 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.6 pt-20 -86.47 -47.75 9.01 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.331 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -53.7 -22.66 9.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.52 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -52.9 -45.7 67.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.017 0.437 . . . . 0.0 111.25 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.536 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 2.2 p-80 -80.03 -23.43 41.44 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.077 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.548 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 27.3 tp -68.05 -38.85 82.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.801 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.4 mt -85.88 -29.64 6.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.612 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.76 -43.23 80.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.786 -179.455 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.612 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -71.35 -18.16 62.39 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.081 0.467 . . . . 0.0 110.196 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.428 ' O ' ' HB2' ' B' ' 599' ' ' ARG . 2.4 pt-20 -63.03 -31.67 72.86 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.469 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.429 ' HG3' ' O ' ' B' ' 592' ' ' TYR . 1.0 OUTLIER -76.95 -49.35 15.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.776 -179.364 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.543 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.3 pp -54.8 -26.54 17.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.155 0.502 . . . . 0.0 110.83 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.64 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 14.8 tp -69.0 -83.36 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.92 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.64 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m -141.35 30.72 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.027 0 CA-C-N 114.656 -1.157 . . . . 0.0 110.707 -177.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' B' ' 594' ' ' GLU . 54.2 mtp180 -138.33 52.45 1.83 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.28 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 31.5 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.104 179.938 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.898 0.38 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 5.1 m -68.52 -171.52 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.242 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -142.01 133.88 27.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.581 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.42 HG21 ' CD2' ' A' ' 477' ' ' PHE . 2.0 t -61.88 115.73 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.019 0.437 . . . . 0.0 110.905 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 27.5 p -131.79 172.18 12.61 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.586 0.707 . . . . 0.0 112.575 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.533 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 17.0 mt-10 -69.04 -54.82 13.07 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.475 -1.239 . . . . 0.0 110.05 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.04 -27.07 7.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.46 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.43 ' O ' ' CD1' ' A' ' 462' ' ' TYR . . . -75.91 -37.92 58.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.752 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.428 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 6.6 t -74.57 -40.81 48.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.863 0.364 . . . . 0.0 111.428 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.533 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 2.4 mmm-85 -54.43 -39.53 67.46 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.232 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -71.01 -26.66 63.22 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.761 179.48 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.43 ' CD1' ' O ' ' A' ' 458' ' ' ALA . 15.6 m-30 -67.59 -36.96 81.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.132 0.491 . . . . 0.0 109.918 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.511 ' CD1' ' HB3' ' A' ' 500' ' ' LEU . 0.6 OUTLIER -74.84 -58.53 3.23 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.082 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.42 -28.26 2.04 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-O 121.15 0.5 . . . . 0.0 110.398 179.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 37.7 mtt85 -85.36 -48.58 8.9 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.561 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.48 130.21 0.54 Allowed Pre-proline 0 CA--C 1.532 0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.984 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.554 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 11.2 Cg_endo -53.65 157.18 10.25 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.753 2.302 . . . . 0.0 112.576 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.473 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.95 172.24 16.0 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.405 0.622 . . . . 0.0 111.694 -179.415 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.53 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 35.1 p -103.73 160.69 14.56 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 177.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.416 ' O ' ' HG ' ' A' ' 474' ' ' LEU . 0.0 OUTLIER -54.52 -43.72 72.14 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.057 -0.657 . . . . 0.0 110.487 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.56 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -61.24 -59.12 5.8 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.797 178.871 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -56.85 -20.44 22.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.581 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.473 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 1.6 tt -87.87 -42.4 12.55 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.015 0.436 . . . . 0.0 111.446 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.49 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 2.0 pp -84.38 -48.04 10.08 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.144 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 32.6 mmtt -48.83 -29.84 5.08 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -179.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.426 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -68.52 -41.68 79.61 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.932 -179.841 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.426 ' CE2' ' HE2' ' A' ' 476' ' ' LYS . 11.5 m-85 -66.47 -30.04 70.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 111.021 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.65 113.84 1.8 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.8 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 3.1 m 74.1 3.28 4.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.392 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 1.1 tptt -63.44 -54.47 36.11 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.823 0.344 . . . . 0.0 110.896 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.28 -33.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.229 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' THR . . . . . . . . . . . . . 14.8 p -54.42 -18.49 4.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.147 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 64.88 17.39 62.96 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.599 -0.81 . . . . 0.0 111.857 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.402 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 1.6 tp -84.58 129.95 34.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.011 0.434 . . . . 0.0 111.088 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.33 151.29 0.37 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.66 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 m -59.96 -24.71 64.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.454 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.434 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 4.3 mt-10 -91.35 -45.78 8.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.553 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -63.46 -41.32 98.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.077 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.488 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 85.6 m -50.32 -30.28 11.69 Favored 'General case' 0 C--N 1.334 -0.087 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 5.0 t -83.62 -39.85 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.989 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -61.04 -31.17 70.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.907 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.501 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 4.0 p -97.1 -12.49 8.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.861 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.496 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 0.3 OUTLIER -91.06 -40.9 11.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.176 0.512 . . . . 0.0 110.024 179.409 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.504 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -50.28 -36.64 32.35 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.257 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.9 OUTLIER -66.9 -42.87 84.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.297 -179.607 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.511 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 7.1 mt -77.74 -43.79 29.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.468 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.496 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.0 OUTLIER -36.05 -57.67 0.69 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.729 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.477 ' N ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -62.52 -22.77 66.55 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.29 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.474 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 1.4 mmp_? -60.14 -19.88 55.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.937 0.399 . . . . 0.0 110.69 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.511 ' HB3' ' CD1' ' A' ' 463' ' ' LEU . 16.4 mt -64.46 -47.92 77.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.044 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.574 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 56.81 59.07 8.21 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.403 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.574 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 73.9 Cg_endo -101.09 -160.22 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 124.02 3.147 . . . . 0.0 111.669 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.76 141.03 49.83 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.681 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.53 134.82 36.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.291 0.567 . . . . 0.0 111.591 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 10.9 mtmt -156.08 160.2 39.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.608 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -103.41 109.96 21.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.977 0.418 . . . . 0.0 111.699 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.499 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.73 110.81 22.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.869 178.896 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 58.35 44.53 18.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.975 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.5 t0 72.83 11.8 5.31 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.478 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 507' ' ' ILE . 1.8 tpmt? -116.08 128.81 55.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.606 0.241 . . . . 0.0 110.701 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' MET . . . . . 0.414 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -62.86 108.63 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.953 0.406 . . . . 0.0 110.581 180.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.53 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 10.4 m170 -122.56 129.47 51.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.825 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.546 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -108.91 123.47 49.13 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.775 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.554 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -177.89 169.34 2.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.059 0.457 . . . . 0.0 111.959 -178.57 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.482 ' N ' HD21 ' A' ' 515' ' ' LEU . 1.5 pt? -114.12 169.13 9.25 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.468 179.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.4 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -137.57 106.71 6.02 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.052 0.453 . . . . 0.0 111.499 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.171 -179.99 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.847 0.356 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -60.24 99.99 0.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.887 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -90.1 48.97 1.63 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.976 0.417 . . . . 0.0 110.56 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.533 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.5 pt-20 -86.45 -46.98 9.71 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.415 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -53.66 -22.61 9.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.582 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -51.76 -47.15 64.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.033 0.444 . . . . 0.0 110.976 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.533 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 2.3 p-80 -80.13 -25.06 40.07 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.04 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.536 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 21.5 tp -58.94 -29.96 67.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.839 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 80.5 mt -85.86 -29.7 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.229 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.574 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.58 -38.13 88.64 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.799 -179.291 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.574 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -78.98 -17.9 54.6 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.153 0.502 . . . . 0.0 110.106 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -61.8 -31.27 71.48 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.817 179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.469 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 8.3 pt-20 -82.49 -47.13 12.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.406 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.555 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.1 pp -51.76 -26.74 7.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.018 0.437 . . . . 0.0 111.219 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.66 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 14.4 tp -68.47 -83.33 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.58 0.705 . . . . 0.0 111.516 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.66 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m -140.93 30.39 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.115 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.43 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.469 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 33.7 mtp85 -142.41 43.68 1.64 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.117 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.172 179.933 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.814 0.34 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . 0.403 ' O ' ' CG2' ' A' ' 482' ' ' THR . 12.7 m -156.91 -168.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.895 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 7.5 mp0 -54.47 122.09 9.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.824 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.436 HG22 ' CD2' ' A' ' 477' ' ' PHE . 4.6 t -63.9 115.94 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.707 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' THR . . . . . 0.433 ' O ' HG22 ' A' ' 459' ' ' VAL . 30.6 p -131.58 159.65 37.6 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.552 0.692 . . . . 0.0 112.644 -179.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 19.8 mt-10 -54.73 -54.69 38.58 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.505 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.34 -28.35 42.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.924 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.416 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -80.22 -33.14 38.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.968 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.439 HG22 HG21 ' A' ' 496' ' ' ILE . 2.8 t -75.8 -36.04 32.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.768 0.318 . . . . 0.0 111.472 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 2.3 mmm-85 -57.46 -38.62 74.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.919 0.39 . . . . 0.0 110.088 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.458 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -70.31 -29.12 65.76 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.562 179.298 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.458 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 7.1 m-30 -64.83 -38.78 92.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.14 0.495 . . . . 0.0 109.813 179.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.504 ' HB2' HD23 ' A' ' 515' ' ' LEU . 0.3 OUTLIER -73.97 -58.27 3.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.193 -179.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.89 -27.8 2.31 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 121.143 0.497 . . . . 0.0 110.478 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -87.57 -49.73 6.98 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.792 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.4 ' CE ' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -169.28 125.98 0.79 Allowed Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.138 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.592 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 9.2 Cg_endo -52.14 158.42 5.16 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.707 2.271 . . . . 0.0 112.878 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.503 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -151.13 168.46 24.58 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-O 121.451 0.643 . . . . 0.0 111.968 -179.528 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.506 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 2.1 p -100.9 176.37 5.3 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 176.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.419 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -71.04 -41.51 70.71 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 119.781 -0.767 . . . . 0.0 110.616 179.655 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.413 ' O ' ' CD ' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -64.62 -49.69 70.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.669 178.659 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . 0.523 ' HA ' ' HD3' ' A' ' 475' ' ' LYS . 11.5 t70 -59.13 -40.1 84.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.247 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.503 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 1.0 OUTLIER -62.15 -41.27 98.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.096 0.474 . . . . 0.0 111.137 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.521 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 1.0 OUTLIER -84.46 -26.03 28.49 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.314 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.523 ' HD3' ' HA ' ' A' ' 472' ' ' ASP . 0.0 OUTLIER -54.85 -36.51 65.13 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.577 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.48 ' CE ' ' HA ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -81.38 -43.75 18.55 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.063 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.436 ' CD2' HG22 ' A' ' 454' ' ' VAL . 11.5 m-85 -65.98 -27.32 68.05 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.288 0.566 . . . . 0.0 109.857 178.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -64.02 113.77 3.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.128 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 72.85 3.36 4.67 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.119 179.534 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 476' ' ' LYS . 1.0 OUTLIER -70.43 -48.31 56.58 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.824 0.345 . . . . 0.0 111.369 -179.717 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.1 tptp -179.43 -27.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.447 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' THR . . . . . 0.403 ' CG2' ' O ' ' A' ' 452' ' ' VAL . 0.0 OUTLIER -45.51 -26.2 0.54 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.844 0.354 . . . . 0.0 110.987 179.698 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 62.86 16.4 56.69 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.497 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 3.3 mp -95.47 129.67 42.55 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 121.004 0.431 . . . . 0.0 111.091 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -39.53 155.06 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.636 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 p -62.7 -20.39 64.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.463 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 4.0 mt-10 -95.48 -39.95 9.72 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.748 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . 0.426 ' HA ' ' HB3' ' A' ' 491' ' ' ASN . 14.0 mt-30 -69.26 -43.76 73.29 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.568 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 90.1 m -49.18 -28.99 4.93 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 121.271 0.558 . . . . 0.0 109.839 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . 0.43 ' CG1' ' HG ' ' B' ' 593' ' ' LEU . 17.4 t -84.28 -39.98 15.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.631 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . 0.426 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 9.4 t30 -60.99 -29.91 69.97 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.975 178.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.52 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.6 p -97.48 -13.14 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.938 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.521 ' CD2' ' HB3' ' A' ' 474' ' ' LEU . 5.6 tp -90.95 -43.76 9.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.129 0.49 . . . . 0.0 110.107 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.519 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -49.29 -33.87 14.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.543 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.9 OUTLIER -69.09 -43.19 75.0 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.877 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.528 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 6.4 mt -78.93 -32.43 15.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -178.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.513 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.1 OUTLIER -46.05 -57.72 4.21 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.679 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.457 ' N ' HD11 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.96 -29.19 68.25 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -178.26 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.49 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 4.0 mmm180 -58.29 -22.08 51.46 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.91 0.386 . . . . 0.0 110.681 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.448 ' CD1' HD12 ' A' ' 463' ' ' LEU . 65.2 mt -58.74 -47.62 83.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.529 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.609 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.1 t-20 56.48 57.45 9.02 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.507 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.609 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.9 Cg_endo -101.74 -163.26 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.44 0 C-N-CA 124.175 3.25 . . . . 0.0 111.843 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . 0.406 ' O ' ' CD ' ' A' ' 505' ' ' LYS . 0.1 OUTLIER -116.39 145.07 43.52 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.038 178.51 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -83.24 132.91 35.02 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.404 0.621 . . . . 0.0 111.985 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.406 ' CD ' ' O ' ' A' ' 503' ' ' GLU . 0.0 OUTLIER -150.32 159.67 44.29 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.455 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' MET . . . . . 0.438 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -105.1 112.17 25.21 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.605 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.445 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.7 OUTLIER -90.89 110.92 22.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.025 179.237 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.7 t30 58.85 41.99 20.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.764 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.3 t70 74.37 14.89 3.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.252 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.438 ' O ' ' HA ' ' A' ' 506' ' ' MET . 0.0 OUTLIER -116.26 131.61 56.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 110.908 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 3.7 tpt -62.54 108.4 1.13 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.93 0.395 . . . . 0.0 110.687 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.506 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 10.4 m170 -122.84 128.81 50.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.408 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.502 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.73 123.36 48.02 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.701 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.592 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.6 OUTLIER 179.11 169.13 0.97 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.107 0.48 . . . . 0.0 111.985 -178.857 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.504 HD23 ' HB2' ' A' ' 463' ' ' LEU . 1.6 pt? -114.04 169.17 9.21 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.382 178.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.42 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -142.42 106.52 4.74 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.083 0.468 . . . . 0.0 111.382 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.847 179.911 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.864 0.364 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -60.48 86.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.917 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . 0.402 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 15.6 t70 -90.07 49.37 1.7 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.95 0.405 . . . . 0.0 110.704 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.482 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 3.1 pp20? -86.38 -40.54 15.31 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.836 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.37 -22.75 30.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.763 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -53.33 -55.21 26.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.011 0.434 . . . . 0.0 111.73 -179.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.664 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.2 p-80 -77.08 -21.63 54.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.334 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.541 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 24.3 tp -60.6 -29.52 69.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.544 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . 0.406 HD13 HG23 ' B' ' 591' ' ' ILE . 79.0 mt -85.75 -34.32 8.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.664 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.78 -40.89 68.93 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.359 -0.537 . . . . 0.0 112.161 -178.901 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.65 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -66.5 -18.54 65.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.103 0.478 . . . . 0.0 110.246 -179.762 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' B' ' 599' ' ' ARG . 4.1 pt-20 -63.4 -30.87 71.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.597 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.427 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.5 OUTLIER -78.1 -47.97 17.08 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.126 -179.115 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.569 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.1 pp -52.33 -26.59 9.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.214 0.531 . . . . 0.0 110.89 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.663 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.1 tp -69.61 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.483 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.663 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 34.4 m -143.75 30.56 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.65 -178.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.427 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 54.6 mtp180 -137.23 38.96 2.51 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.221 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 10.5 p . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.316 -0.85 . . . . 0.0 111.089 179.937 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 2.6 p30 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.861 0.363 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . 0.465 ' O ' ' HA ' ' A' ' 482' ' ' THR . 7.5 p -60.86 159.69 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.077 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.24 131.97 9.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.85 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.45 HG22 ' CD2' ' A' ' 477' ' ' PHE . 79.0 t -68.25 108.63 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.555 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 455' ' ' THR . . . . . 0.407 ' O ' HG21 ' A' ' 459' ' ' VAL . 23.4 p -131.52 157.78 42.66 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 121.556 0.693 . . . . 0.0 112.481 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.532 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 22.9 mt-10 -51.38 -53.36 37.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.475 -1.239 . . . . 0.0 110.941 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.71 -31.46 72.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.56 -179.151 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.437 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -71.37 -36.69 71.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.396 -179.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.489 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 16.4 t -72.31 -25.7 23.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.121 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.532 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.2 OUTLIER -63.11 -51.04 68.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.109 0.48 . . . . 0.0 109.814 178.769 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.471 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -54.93 -28.09 48.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 179.394 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.489 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 12.9 m-30 -68.81 -45.31 71.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.148 179.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.528 ' CB ' HD13 ' A' ' 515' ' ' LEU . 0.7 OUTLIER -68.47 -57.4 5.88 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.238 179.704 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -48.84 -24.51 1.47 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.789 179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.553 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 24.4 ttp180 -93.35 -31.33 14.7 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.531 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.553 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER 169.89 162.7 0.2 Allowed Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.662 -179.588 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.718 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 73.9 Cg_endo -72.0 163.31 39.2 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.341 2.027 . . . . 0.0 113.34 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.475 ' CE ' ' CD1' ' A' ' 513' ' ' PHE . 0.0 OUTLIER -152.15 152.64 32.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.383 -178.794 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.422 HG23 ' CE1' ' A' ' 512' ' ' HIS . 0.6 OUTLIER -95.9 162.4 13.59 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.021 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.513 HG21 HD22 ' B' ' 593' ' ' LEU . 1.8 p -65.3 -34.11 77.57 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.853 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.541 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -73.63 -50.91 18.73 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.35 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -59.73 -19.68 51.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.228 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.515 HD13 HD12 ' A' ' 497' ' ' LEU . 0.4 OUTLIER -75.24 -41.25 57.91 Favored 'General case' 0 C--O 1.23 0.051 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.133 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.436 ' CD2' ' CD1' ' B' ' 590' ' ' LEU . 1.3 pp -84.33 -46.53 11.66 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.541 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 37.4 mmtt -46.69 -29.23 1.78 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.773 0.32 . . . . 0.0 111.479 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.461 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -78.06 -41.24 36.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.642 179.547 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.461 ' CE2' ' HE2' ' A' ' 476' ' ' LYS . 16.5 m-85 -69.86 -67.71 0.47 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.298 0.57 . . . . 0.0 110.073 179.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . 0.436 ' CG ' ' O ' ' A' ' 477' ' ' PHE . 7.0 pt20 47.72 174.43 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.089 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.69 -1.55 25.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.534 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 22.4 tptt -45.91 -29.62 1.46 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.608 0.242 . . . . 0.0 111.476 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.6 mmmt -149.21 -43.47 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.49 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' THR . . . . . 0.465 ' HA ' ' O ' ' A' ' 452' ' ' VAL . 60.8 p -54.66 -17.2 3.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.051 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 63.82 18.27 61.69 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.19 -178.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.4 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 4.3 mp -108.13 122.16 46.32 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 120.961 0.41 . . . . 0.0 111.279 -179.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.26 156.72 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.729 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.26 -24.13 67.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.09 178.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.411 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 10.7 mt-10 -88.84 -48.35 7.54 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.577 179.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -60.42 -43.25 96.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.997 179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.415 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 92.7 m -49.43 -29.36 6.33 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 121.111 0.481 . . . . 0.0 109.785 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . 0.452 ' HA ' ' HB3' ' A' ' 493' ' ' LEU . 8.2 t -83.55 -40.97 16.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.937 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -60.96 -29.78 69.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.98 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.436 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 6.8 p -99.03 -6.97 9.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.823 179.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.453 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 9.6 tp -94.88 -34.58 12.38 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.003 0.43 . . . . 0.0 110.483 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.454 ' HB3' ' CD1' ' B' ' 596' ' ' ILE . . . -61.29 -37.02 81.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.109 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.436 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.5 OUTLIER -66.45 -45.27 80.34 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.849 -179.483 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.498 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 10.9 mt -73.93 -40.15 52.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.79 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.515 HD12 HD13 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -38.82 -63.04 0.55 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.891 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.496 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.5 -27.99 66.65 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -58.81 -21.06 55.44 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.083 0.468 . . . . 0.0 110.992 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.493 ' HB3' ' CD1' ' A' ' 463' ' ' LEU . 84.5 mt -61.67 -47.76 83.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.503 -179.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.586 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.9 t-20 60.95 57.67 3.59 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.04 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.586 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 58.5 Cg_endo -101.22 -160.63 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 124.291 3.327 . . . . 0.0 111.771 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.95 138.21 54.5 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.782 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.68 133.61 36.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.388 0.613 . . . . 0.0 111.719 -178.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -156.33 146.99 21.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.81 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 506' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -89.22 111.26 22.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.94 0.4 . . . . 0.0 111.362 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.462 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.78 110.93 22.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.172 179.299 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 1.5 t30 60.06 41.85 16.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.906 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 3.9 t0 74.22 13.82 3.87 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.223 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.405 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.08 130.64 56.9 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.838 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.51 108.7 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 0.0 110.718 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.451 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 19.4 m80 -122.58 155.75 35.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.673 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.542 ' CE1' HD23 ' B' ' 597' ' ' LEU . 5.3 p90 -134.29 123.69 24.62 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.757 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.718 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER 179.77 169.43 1.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.391 0.615 . . . . 0.0 112.03 -178.99 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.552 ' CD2' ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -118.54 168.86 10.28 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.425 178.454 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.503 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -135.07 106.02 6.61 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.167 0.508 . . . . 0.0 111.165 179.369 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.023 -179.971 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.813 0.34 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -60.36 91.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.892 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . 0.516 ' O2P' ' CG2' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . 0.409 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 17.0 t70 -90.07 49.36 1.7 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.015 0.436 . . . . 0.0 110.73 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.464 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 0.0 OUTLIER -86.41 -37.62 18.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.984 179.52 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.09 -22.87 31.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.784 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -52.72 -55.16 24.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.091 0.472 . . . . 0.0 111.56 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.464 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.0 OUTLIER -79.7 -21.89 44.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.181 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.567 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 28.2 tp -52.0 -39.81 60.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.043 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 54.5 mt -86.06 -29.71 6.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.134 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.559 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.57 -39.61 84.9 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.45 -179.781 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.614 ' O ' HG13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -78.52 -18.0 55.38 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.156 0.503 . . . . 0.0 109.92 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.617 ' HA ' HG22 ' A' ' 470' ' ' THR . 0.4 OUTLIER -63.43 -30.76 71.84 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.974 179.709 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.634 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 6.5 pt-20 -80.73 -47.41 14.0 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.614 HG13 ' O ' ' B' ' 593' ' ' LEU . 1.5 pp -50.15 -26.54 3.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.138 0.494 . . . . 0.0 110.991 179.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.621 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 11.9 tp -64.63 -83.77 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.307 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.621 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.8 m -136.09 31.2 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.147 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.188 -177.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.634 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 1.7 mtp-105 -136.8 108.14 6.86 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.161 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.2 p . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.135 179.994 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 6.8 p30 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.876 0.369 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 16.3 m -155.38 -166.41 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -137.11 132.9 34.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.821 0.344 . . . . 0.0 110.653 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.451 HG22 ' CD2' ' A' ' 477' ' ' PHE . 7.5 t -77.87 104.71 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.636 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 23.2 p -132.02 164.29 26.52 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.539 0.685 . . . . 0.0 112.192 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.53 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 18.6 mt-10 -57.33 -53.47 57.79 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.506 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.99 -29.22 63.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.07 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.406 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -74.6 -35.06 62.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.644 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.474 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 14.2 t -76.02 -28.36 18.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 120.859 -0.337 . . . . 0.0 111.511 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.53 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -62.73 -50.82 69.57 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.98 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.444 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -55.43 -27.04 45.46 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.356 179.053 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.507 ' O ' ' O ' ' A' ' 466' ' ' LYS . 11.4 m-30 -68.38 -44.44 75.14 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.54 ' CB ' HD13 ' A' ' 515' ' ' LEU . 0.4 OUTLIER -70.58 -54.36 12.36 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.099 179.318 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -48.09 -24.65 1.17 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.673 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.603 ' O ' ' HG2' ' A' ' 466' ' ' LYS . 3.5 ptp85 -97.04 -47.84 5.63 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.336 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.661 ' HD3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -165.77 166.79 9.64 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 122.316 0.247 . . . . 0.0 110.708 179.905 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.661 ' HD2' ' HD3' ' A' ' 466' ' ' LYS . 97.0 Cg_endo -77.15 162.86 31.17 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.276 1.984 . . . . 0.0 113.551 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.407 ' HB2' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -156.14 151.16 26.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.168 -178.74 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.485 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 10.9 p -99.11 175.06 6.03 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.617 HG22 ' HA ' ' B' ' 594' ' ' GLU . 0.6 OUTLIER -71.31 -31.52 67.53 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.333 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.574 ' HD2' ' H ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -77.0 -53.52 7.72 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.325 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -57.89 -19.94 33.2 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.757 178.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.471 ' CD1' ' CD1' ' A' ' 497' ' ' LEU . 6.8 mt -77.27 -40.92 42.94 Favored 'General case' 0 C--O 1.23 0.054 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 471' ' ' LYS . 1.6 pp -84.22 -47.37 10.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 18.0 mmtp -46.85 -28.33 1.53 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.698 0.285 . . . . 0.0 111.484 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.492 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -79.56 -41.03 28.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.653 179.545 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.492 ' CE2' ' HE2' ' A' ' 476' ' ' LYS . 16.8 m-85 -69.9 -67.31 0.5 Allowed 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.529 0.681 . . . . 0.0 110.053 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 53.4 173.93 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.712 -1.131 . . . . 0.0 111.507 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 11.5 t -75.06 -21.14 59.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.133 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -17.12 34.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.438 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -113.68 -75.59 0.6 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.78 0.324 . . . . 0.0 111.836 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' THR . . . . . 0.437 ' OG1' ' HB2' ' A' ' 484' ' ' LEU . 30.2 p -74.07 9.4 1.6 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.758 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 58.41 19.78 42.1 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.788 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.437 ' HB2' ' OG1' ' A' ' 482' ' ' THR . 1.5 mp -105.46 122.88 46.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.919 0.39 . . . . 0.0 111.422 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.93 154.23 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.82 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 74.2 m -61.15 -26.41 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.139 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -84.61 -53.28 5.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.443 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.66 -40.48 87.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.023 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 44.2 m -51.43 -31.06 21.62 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . 0.464 ' HA ' ' HB3' ' A' ' 493' ' ' LEU . 2.5 t -78.86 -42.59 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.309 179.321 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.51 -34.05 72.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.897 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.508 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.3 p -93.7 -10.46 9.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.75 179.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.562 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 21.2 tp -90.24 -44.39 9.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.092 0.473 . . . . 0.0 110.554 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.477 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -51.61 -33.9 35.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.69 -179.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.74 -41.9 78.34 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.216 -179.093 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.511 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 10.5 mt -79.13 -29.95 14.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.562 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.3 OUTLIER -47.63 -58.35 4.38 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.489 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.516 ' H ' ' HD2' ' A' ' 498' ' ' LYS . 0.0 OUTLIER -59.42 -28.05 66.59 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -177.856 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.502 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.5 mmm180 -60.38 -20.84 61.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.057 0.456 . . . . 0.0 110.19 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.54 ' HB3' HD12 ' A' ' 463' ' ' LEU . 77.4 mt -59.59 -47.61 84.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.037 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.621 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 28.0 t-20 55.36 54.5 9.71 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.164 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.621 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 69.7 Cg_endo -101.25 -160.15 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 124.071 3.181 . . . . 0.0 111.596 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.19 140.44 50.19 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.834 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.7 133.57 36.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.316 0.579 . . . . 0.0 111.477 -178.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -156.36 132.11 9.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.989 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.18 108.86 13.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.876 0.369 . . . . 0.0 111.396 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.448 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.61 110.8 22.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.938 179.047 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 66.2 t30 59.64 43.9 15.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.857 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.6 t0 72.4 13.29 5.54 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.279 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.423 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.08 128.44 55.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.777 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.98 108.65 0.9 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.041 0.448 . . . . 0.0 110.519 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.518 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 24.7 m80 -122.8 132.82 54.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.211 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.485 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.0 OUTLIER -108.51 123.77 49.41 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.788 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.637 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER -171.82 169.69 5.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.556 0.693 . . . . 0.0 112.762 -178.735 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.553 ' CD2' ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -129.19 168.92 15.46 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.341 178.401 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.472 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -131.44 105.78 7.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.064 0.459 . . . . 0.0 110.9 179.106 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.918 179.999 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.886 0.374 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -60.34 87.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -90.12 49.78 1.76 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.019 0.438 . . . . 0.0 110.721 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.455 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.0 pt-20 -86.12 -35.2 20.33 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.816 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.06 -22.78 31.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.566 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -53.45 -55.16 27.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.077 0.465 . . . . 0.0 111.561 -179.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.455 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 0.9 OUTLIER -80.01 -21.81 43.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.235 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.537 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 39.1 tp -48.63 -29.54 4.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.299 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 79.1 mt -85.61 -29.77 6.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.216 -179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.574 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.48 -52.13 65.77 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.15 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.574 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -66.51 -17.94 65.09 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.497 -179.612 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.458 ' HA ' HG23 ' A' ' 470' ' ' THR . 1.0 OUTLIER -62.28 -30.87 71.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.968 -179.682 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.46 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 1.6 pt-20 -82.52 -43.73 16.79 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.566 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.3 pp -53.86 -26.5 14.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.097 0.475 . . . . 0.0 111.172 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.652 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.6 tp -71.1 -82.65 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.557 0.694 . . . . 0.0 112.041 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.652 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.4 m -140.5 29.87 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.627 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.46 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 25.4 mtp180 -141.7 40.83 1.7 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.181 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 9.7 p . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.07 -179.992 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 33.1 p-10 . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.84 0.352 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 14.0 p -167.14 160.66 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.095 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -41.72 131.4 3.15 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.877 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.479 HG23 ' CG ' ' A' ' 477' ' ' PHE . 59.3 t -90.42 116.89 32.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.648 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 455' ' ' THR . . . . . 0.413 ' O ' HG23 ' A' ' 459' ' ' VAL . 25.4 p -131.65 163.36 28.28 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.642 0.734 . . . . 0.0 112.503 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.53 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 22.3 mt-10 -58.56 -52.57 65.1 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.51 -1.223 . . . . 0.0 110.933 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.03 -27.49 68.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.581 -178.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.448 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -70.07 -58.18 4.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.738 0.304 . . . . 0.0 111.62 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.542 ' O ' ' HG ' ' A' ' 463' ' ' LEU . 16.9 t -48.17 -31.72 3.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.946 0.403 . . . . 0.0 110.9 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.8 OUTLIER -54.69 -47.99 72.98 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.259 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -63.35 -27.88 69.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.507 179.452 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.512 ' CE2' ' CE2' ' A' ' 477' ' ' PHE . 8.2 m-30 -68.78 -42.9 76.76 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.289 0.566 . . . . 0.0 109.649 178.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 459' ' ' VAL . 3.7 mt -70.35 -60.29 2.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.964 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -49.44 -24.43 1.99 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.065 -179.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -92.93 -46.04 7.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.508 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.478 ' HD2' ' HD2' ' A' ' 467' ' ' PRO . 1.4 mmmt -165.2 128.8 1.67 Allowed Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.005 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.611 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 18.0 Cg_endo -56.17 146.09 72.85 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.358 2.039 . . . . 0.0 112.716 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.491 ' HE1' ' O ' ' A' ' 513' ' ' PHE . 0.0 OUTLIER -132.78 178.23 7.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.278 -179.276 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.508 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 10.1 p -124.16 160.71 27.24 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.094 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.507 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.7 OUTLIER -58.22 -30.84 66.82 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.192 -0.603 . . . . 0.0 111.251 -179.174 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.477 ' HA ' ' CD1' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -76.53 -50.84 12.93 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.823 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . 0.417 ' HA ' ' CD ' ' A' ' 475' ' ' LYS . 11.9 t70 -64.79 -31.04 72.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.86 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.523 ' O ' ' HE3' ' A' ' 476' ' ' LYS . 0.5 OUTLIER -60.13 -42.36 94.62 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.164 0.507 . . . . 0.0 110.985 -179.558 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.467 ' CD2' ' CD1' ' B' ' 590' ' ' LEU . 2.9 pp -85.24 -25.03 27.53 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.555 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.472 ' HD2' ' O ' ' A' ' 471' ' ' LYS . 4.1 mttt -46.05 -36.32 5.62 Favored 'General case' 0 N--CA 1.461 0.109 0 N-CA-C 111.628 0.232 . . . . 0.0 111.628 -178.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.523 ' HE3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -93.43 -43.23 8.85 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.135 179.573 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.512 ' CE2' ' CE2' ' A' ' 462' ' ' TYR . 3.0 m-85 -59.35 -30.42 68.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.381 0.61 . . . . 0.0 110.158 179.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.17 113.79 9.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.908 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 97.8 m -164.89 -76.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.891 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp 177.6 -34.15 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.177 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.75 -47.15 59.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.459 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' THR . . . . . . . . . . . . . 75.9 p -60.66 -11.96 8.89 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.004 179.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 58.3 21.89 49.01 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 120.337 -0.935 . . . . 0.0 110.827 -178.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.417 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 0.2 OUTLIER -114.87 119.62 37.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.191 -0.505 . . . . 0.0 111.407 -179.054 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.51 161.09 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.496 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 98.9 p -60.89 -24.98 66.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.021 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -91.02 -43.51 9.89 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.349 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -64.08 -41.24 97.39 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.918 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 91.8 m -51.75 -27.7 12.9 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.714 178.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 6.6 t -84.94 -40.37 14.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.813 178.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -61.09 -32.0 71.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.911 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.511 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.7 p -94.01 -11.15 9.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.752 179.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.471 ' CD1' ' CD2' ' A' ' 497' ' ' LEU . 21.8 tp -89.85 -43.04 10.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.216 0.531 . . . . 0.0 110.204 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.464 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -51.97 -33.54 38.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.658 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.23 -42.88 79.11 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.891 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.53 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 9.9 mt -72.86 -45.28 56.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -178.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.507 ' HG ' ' CG2' ' A' ' 470' ' ' THR . 0.7 OUTLIER -37.38 -64.01 0.4 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.6 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.501 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.61 -27.06 65.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.991 0.424 . . . . 0.0 111.261 -179.282 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.71 -26.5 68.7 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.547 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.44 HD22 ' HD2' ' A' ' 460' ' ' ARG . 67.3 mt -60.36 -47.37 86.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.918 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.553 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 59.12 59.69 5.13 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.732 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.553 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 91.7 Cg_endo -101.19 -159.25 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.326 0 C-N-CA 124.04 3.16 . . . . 0.0 111.317 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.39 141.53 48.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.738 178.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -79.47 134.23 36.53 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.321 0.581 . . . . 0.0 111.292 -179.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -156.12 157.95 36.87 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.857 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 506' ' ' MET . . . . . 0.432 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.8 OUTLIER -105.19 109.94 22.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.93 0.395 . . . . 0.0 111.532 -179.757 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.467 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.72 110.79 22.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.867 178.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 59.51 44.41 14.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.739 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 6.5 t0 71.16 13.83 6.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.257 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.452 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.15 134.69 54.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.784 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.78 108.74 2.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.937 0.399 . . . . 0.0 110.88 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.508 ' CE1' ' CG2' ' A' ' 469' ' ' THR . 25.6 m80 -123.05 130.7 53.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.093 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.492 ' CD2' ' CD2' ' B' ' 597' ' ' LEU . 0.0 OUTLIER -105.0 125.44 50.98 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.092 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.611 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER -175.29 169.33 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.78 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.545 HD22 ' N ' ' A' ' 515' ' ' LEU . 1.2 pt? -122.74 169.14 11.38 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.062 178.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.79 106.75 8.31 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.434 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.044 -179.993 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.844 0.354 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -60.69 86.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.926 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -90.2 49.13 1.65 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.022 0.439 . . . . 0.0 110.598 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.562 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.2 pt-20 -86.52 -47.31 9.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.357 179.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -53.53 -22.46 8.27 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.554 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -57.51 -40.8 79.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.899 0.381 . . . . 0.0 111.413 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.562 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 2.1 p-80 -80.32 -21.87 42.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.724 -179.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.541 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 16.6 tp -53.5 -31.05 44.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.957 0.408 . . . . 0.0 110.72 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.7 mt -85.76 -29.59 6.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.892 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.578 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.42 -38.74 92.1 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.809 -179.441 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.578 ' N ' ' CD1' ' B' ' 592' ' ' TYR . 0.0 OUTLIER -78.39 -18.0 55.65 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.191 0.52 . . . . 0.0 109.988 -179.887 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.475 ' HA ' HG22 ' A' ' 470' ' ' THR . 1.1 pt-20 -62.37 -30.75 71.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.844 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.565 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 7.5 pt-20 -82.2 -48.49 11.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.316 -179.101 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.511 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.3 pp -52.39 -26.8 9.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.22 0.533 . . . . 0.0 111.211 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.632 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.8 tp -60.87 -84.86 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.343 -0.844 . . . . 0.0 113.027 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.632 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 34.8 m -131.74 39.85 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.156 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.679 -177.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.565 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 39.6 mtp180 -129.45 100.34 5.52 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.2 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.072 179.99 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.86 0.362 . . . . 0.0 111.226 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . 0.509 ' O ' ' HA ' ' A' ' 482' ' ' THR . 7.6 p -169.51 160.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.045 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -156.1 132.26 9.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.896 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.452 HG22 ' CD2' ' A' ' 477' ' ' PHE . 93.1 t -66.45 111.85 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.349 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.564 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 455' ' ' THR . . . . . 0.406 ' CA ' HD12 ' A' ' 496' ' ' ILE . 23.6 p -131.49 163.66 27.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.634 0.73 . . . . 0.0 112.361 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.501 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 21.7 mt-10 -57.99 -53.08 62.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.67 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.49 -28.09 68.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.0 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -67.51 -58.07 5.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.828 0.346 . . . . 0.0 111.36 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.508 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 21.2 t -50.58 -28.83 6.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.581 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.9 OUTLIER -58.5 -45.49 88.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.978 0.418 . . . . 0.0 110.434 179.036 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -60.87 -25.38 66.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.929 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.508 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 8.8 m-30 -77.83 -39.74 42.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.832 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.475 HD13 ' CD1' ' A' ' 500' ' ' LEU . 0.9 OUTLIER -70.08 -61.4 1.79 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.233 179.914 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -48.37 -27.27 2.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.093 0.473 . . . . 0.0 110.563 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 45.1 ttp180 -87.1 -50.32 6.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.907 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.417 ' HD2' ' HD2' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -167.46 128.28 1.18 Allowed Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.612 -179.839 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.649 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 9.0 Cg_endo -48.78 169.7 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.234 1.956 . . . . 0.0 112.502 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.431 ' HE2' ' CD1' ' A' ' 513' ' ' PHE . 0.0 OUTLIER -156.42 -178.55 7.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.601 0.715 . . . . 0.0 111.88 -178.801 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.458 HG23 ' CE1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -119.84 170.61 9.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.59 -1.186 . . . . 0.0 107.818 177.744 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.475 HG22 ' HA ' ' B' ' 594' ' ' GLU . 0.6 OUTLIER -71.15 -32.86 69.47 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.074 -0.65 . . . . 0.0 110.612 179.682 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.56 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -76.86 -46.66 23.79 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.461 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -64.25 -20.53 66.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.534 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 476' ' ' LYS . 4.8 mt -78.39 -37.23 44.53 Favored 'General case' 0 C--N 1.334 -0.081 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.441 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 1.4 pp -82.46 -49.51 9.86 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.132 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 16.1 mmtp -46.72 -28.84 1.64 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -75.76 -43.0 48.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.921 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.452 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.5 m-85 -66.79 -65.56 0.66 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.475 0.655 . . . . 0.0 110.294 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 53.6 174.22 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.455 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.48 3.03 19.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.545 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -45.74 -39.8 8.61 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.697 0.284 . . . . 0.0 111.533 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -141.09 -43.15 0.38 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.493 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' THR . . . . . 0.509 ' HA ' ' O ' ' A' ' 452' ' ' VAL . 60.2 p -53.77 -17.64 2.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.221 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 65.99 19.22 67.59 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.479 -179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.412 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 0.2 OUTLIER -108.49 120.62 42.96 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.953 0.406 . . . . 0.0 111.096 -179.573 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.12 160.82 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.532 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -23.93 63.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.162 0.506 . . . . 0.0 109.741 178.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.425 ' HG3' ' CE1' ' B' ' 589' ' ' HIS . 10.5 tt0 -89.77 -51.4 5.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.167 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -59.06 -41.68 88.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.019 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 91.9 m -50.61 -30.5 13.5 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.715 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . 0.478 ' HA ' ' HB3' ' A' ' 493' ' ' LEU . 3.4 t -82.57 -40.59 16.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.184 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -60.37 -30.74 69.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.962 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.489 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 5.6 p -99.01 -6.94 9.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.835 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.518 ' HG ' HD23 ' A' ' 497' ' ' LEU . 13.8 tp -94.29 -40.79 9.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.032 0.444 . . . . 0.0 110.557 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.482 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -54.67 -38.02 66.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.442 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.489 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.59 -41.92 95.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.935 -179.286 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.501 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 13.7 mt -77.75 -48.17 24.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.518 HD23 ' HG ' ' A' ' 493' ' ' LEU . 0.0 OUTLIER -31.58 -64.05 0.16 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.487 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.511 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -60.18 -29.82 68.95 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.415 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -55.52 -23.3 25.57 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.971 0.415 . . . . 0.0 111.036 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.475 ' CD1' HD13 ' A' ' 463' ' ' LEU . 16.0 mt -63.1 -47.45 82.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.654 -179.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.552 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 60.68 59.83 3.65 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.013 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.552 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 53.1 Cg_endo -99.78 -159.24 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 123.983 3.122 . . . . 0.0 111.6 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.55 140.19 51.83 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.828 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.59 134.89 36.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.369 0.604 . . . . 0.0 111.713 -178.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -156.22 160.08 39.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.588 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 506' ' ' MET . . . . . 0.419 ' HE1' ' HA ' ' A' ' 509' ' ' ASP . 8.6 ptm -97.79 109.95 22.61 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.137 0.494 . . . . 0.0 111.589 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.536 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.3 OUTLIER -90.63 110.92 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.852 179.103 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 60.37 38.77 19.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.719 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . 0.419 ' HA ' ' HE1' ' A' ' 506' ' ' MET . 5.2 t70 77.86 10.15 2.21 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.573 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.46 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.24 134.23 55.14 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.619 0.247 . . . . 0.0 111.088 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 511' ' ' MET . . . . . 0.405 ' O ' ' CG2' ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.04 108.61 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.098 0.475 . . . . 0.0 111.004 -179.974 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.536 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 2.2 m80 -122.62 148.37 45.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.436 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.489 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -126.1 123.31 38.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.245 179.666 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.649 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -176.68 169.3 2.54 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.142 0.496 . . . . 0.0 111.945 -179.129 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.494 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.6 pt? -114.24 169.15 9.24 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.404 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.419 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -142.35 106.43 4.74 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.029 0.443 . . . . 0.0 111.378 179.683 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.826 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.768 0.318 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -63.13 82.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.935 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -90.23 49.13 1.65 Allowed 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 120.992 0.425 . . . . 0.0 110.651 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.536 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 3.0 pp20? -86.45 -45.39 11.19 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.421 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -53.73 -22.76 9.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.539 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.87 -47.28 64.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.962 0.411 . . . . 0.0 111.376 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.536 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 2.1 p-80 -80.07 -21.85 42.93 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.238 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.625 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 26.1 tp -62.95 -43.61 98.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.793 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 51.3 mt -86.13 -29.55 6.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 120.813 0.34 . . . . 0.0 111.009 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.567 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -63.28 -44.97 93.55 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.643 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.625 ' CD1' ' O ' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -69.69 -19.72 63.57 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.38 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -63.13 -30.86 71.93 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.337 179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.32 -44.45 62.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.495 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.479 HD11 ' HB3' ' A' ' 494' ' ' ALA . 4.8 pt -58.17 -26.64 30.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.184 0.516 . . . . 0.0 110.963 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.647 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.0 tp -72.73 -81.78 0.05 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.04 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.647 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.0 m -141.14 30.28 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.054 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.731 -177.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -138.93 38.8 2.16 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.368 -179.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 30.2 m . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.111 -179.956 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.741 0.305 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 21.8 t -61.88 144.13 14.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.099 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.13 133.4 44.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.775 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.46 ' CG2' ' CG ' ' A' ' 477' ' ' PHE . 0.9 OUTLIER -84.33 114.88 25.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.796 179.903 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 455' ' ' THR . . . . . 0.433 ' O ' HG21 ' A' ' 459' ' ' VAL . 27.4 p -131.65 169.87 15.55 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.557 0.694 . . . . 0.0 112.654 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.514 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 20.6 mt-10 -69.13 -54.7 13.59 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.271 179.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.96 -26.76 6.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.758 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.431 ' O ' ' CD1' ' A' ' 462' ' ' TYR . . . -77.16 -35.54 55.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.85 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.471 HG21 HG21 ' A' ' 496' ' ' ILE . 4.0 t -76.1 -40.15 36.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.876 0.37 . . . . 0.0 111.392 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.6 mmm180 -53.99 -39.24 65.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.254 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.455 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -70.8 -28.83 64.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.614 179.334 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.455 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 14.2 m-30 -65.69 -36.95 85.1 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.497 ' HB2' HD23 ' A' ' 515' ' ' LEU . 0.5 OUTLIER -74.27 -55.96 5.44 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.838 179.718 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -50.48 -25.36 3.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.679 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.405 ' HG3' ' N ' ' A' ' 466' ' ' LYS . 24.6 ptt180 -92.99 -39.45 11.1 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.223 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -176.73 132.24 0.38 Allowed Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 120.72 0.295 . . . . 0.0 111.044 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.636 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 18.0 Cg_endo -58.06 152.47 51.48 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.752 2.301 . . . . 0.0 113.41 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.452 ' HA ' ' CD2' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -150.09 161.36 42.51 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.507 -179.505 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.461 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 11.6 p -96.62 -178.41 4.25 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.409 HG23 ' CD2' ' B' ' 593' ' ' LEU . 0.2 OUTLIER -71.06 -44.71 65.2 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.687 -0.805 . . . . 0.0 110.88 179.593 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.507 ' H ' ' CD ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -62.32 -51.88 65.88 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.995 179.284 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . 0.428 ' H ' ' HG2' ' A' ' 471' ' ' LYS . 36.4 t70 -57.85 -26.71 62.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.388 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 469' ' ' THR . 1.0 OUTLIER -83.05 -41.52 18.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.104 0.478 . . . . 0.0 111.37 -179.654 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.433 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 2.6 pp -83.98 -25.94 29.62 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -178.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.47 ' HD2' ' HB2' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -48.24 -33.59 8.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.685 0.279 . . . . 0.0 111.607 -178.986 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.453 ' HE2' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -87.5 -43.11 12.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.41 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.46 ' CG ' ' CG2' ' A' ' 454' ' ' VAL . 3.8 m-85 -61.15 -12.46 12.65 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 179.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.44 174.09 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.11 0.481 . . . . 0.0 111.738 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 1.1 m -53.12 -17.27 1.49 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.88 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -37.6 -32.93 0.06 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 112.141 0.422 . . . . 0.0 112.141 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.2 -55.0 0.31 Allowed 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' THR . . . . . . . . . . . . . 17.0 p -56.78 -12.82 2.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.35 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 68.62 17.68 71.2 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.514 -0.85 . . . . 0.0 111.587 -179.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -104.57 123.21 47.13 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 120.857 0.361 . . . . 0.0 111.058 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.42 150.83 0.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.916 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 6.3 t -61.43 -23.09 65.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.373 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.434 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 7.9 mt-10 -90.94 -48.44 7.0 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.598 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -45.18 94.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.257 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 91.1 m -49.56 -35.37 20.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.132 179.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 2.2 t -75.75 -44.1 39.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.078 179.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.15 -26.2 49.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.082 179.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.46 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 8.7 p -102.17 -15.29 7.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.085 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.473 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 1.8 tp -89.04 -42.52 11.7 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.106 0.479 . . . . 0.0 110.823 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.503 ' O ' ' HD2' ' A' ' 498' ' ' LYS . . . -51.29 -37.12 45.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.604 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.46 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.33 -37.88 89.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.668 -179.506 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.514 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 8.0 mt -78.73 -42.52 25.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.473 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 3.2 mm? -41.83 -50.4 4.39 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.503 ' HD2' ' O ' ' A' ' 494' ' ' ALA . 0.0 OUTLIER -61.18 -25.62 67.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.834 0.349 . . . . 0.0 111.593 -179.157 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.448 ' HG3' ' CG ' ' A' ' 456' ' ' GLU . 9.1 mmp_? -64.16 -19.04 65.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.969 0.414 . . . . 0.0 110.478 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.467 HD21 ' HD2' ' A' ' 460' ' ' ARG . 64.8 mt -62.13 -47.48 84.4 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.839 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.606 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.3 t-20 54.66 57.08 11.95 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.334 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.606 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 83.1 Cg_endo -102.24 -159.75 0.04 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.454 0 C-N-CA 123.967 3.111 . . . . 0.0 111.672 -179.251 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.05 140.44 51.0 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.659 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 35.4 ptt85 -79.52 134.59 36.5 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.342 0.591 . . . . 0.0 111.435 -178.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt -156.02 160.26 39.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.757 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 8.3 ptm -103.72 110.23 22.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.941 0.4 . . . . 0.0 111.555 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.523 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.68 110.88 22.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.882 179.011 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 56.0 t30 59.7 40.52 19.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.685 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 75.7 12.54 3.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.373 -180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.433 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.18 131.76 56.85 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.619 0.247 . . . . 0.0 111.003 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.67 108.7 1.03 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.057 0.456 . . . . 0.0 110.69 179.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.523 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 9.1 m80 -122.6 131.4 53.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.063 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.468 ' CE2' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -109.81 123.75 50.1 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.848 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.636 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -179.23 169.11 1.5 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.22 0.533 . . . . 0.0 112.236 -178.858 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.527 ' N ' HD21 ' A' ' 515' ' ' LEU . 1.4 pt? -119.33 169.23 10.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.44 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.423 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -139.26 106.3 5.45 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.987 0.422 . . . . 0.0 111.264 179.541 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.769 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.855 0.359 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -61.8 84.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . 0.408 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 12.4 p30 -85.26 49.62 1.79 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 120.855 0.36 . . . . 0.0 111.059 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.458 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 2.5 pp20? -85.9 -36.68 19.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.301 0.572 . . . . 0.0 110.514 179.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -84.25 -22.65 30.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.459 -179.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -53.8 -55.14 29.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.09 0.472 . . . . 0.0 111.367 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.458 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.1 p-80 -80.15 -21.88 42.62 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.224 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.59 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 24.7 tp -48.33 -33.79 9.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.128 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 68.4 mt -85.89 -29.65 6.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.86 0.362 . . . . 0.0 110.512 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.55 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -63.7 -40.38 96.65 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.15 179.906 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.59 ' CD1' ' O ' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -80.16 -18.15 50.51 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.267 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . . . . . . . . . 71.0 tt0 -63.06 -30.91 71.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.863 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.467 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 9.6 pt-20 -80.63 -48.06 13.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.164 -179.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.56 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.3 pp -52.2 -26.63 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.168 0.508 . . . . 0.0 110.893 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.667 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.4 tp -69.53 -82.65 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.936 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.667 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 30.8 m -140.47 29.27 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.319 -177.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.5 OUTLIER -143.25 39.24 1.43 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.241 -179.526 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.318 -0.848 . . . . 0.0 111.101 179.978 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.859 0.361 . . . . 0.0 111.277 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 7.3 p -62.83 124.99 18.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.111 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.97 134.14 43.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.744 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.493 ' CG2' ' CD2' ' A' ' 477' ' ' PHE . 1.4 t -66.37 115.9 4.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.955 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 455' ' ' THR . . . . . 0.403 ' O ' HG22 ' A' ' 459' ' ' VAL . 33.1 p -131.56 169.12 16.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.609 0.718 . . . . 0.0 112.537 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.504 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 26.6 mt-10 -69.24 -53.49 19.6 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.591 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.66 -27.87 59.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.158 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.403 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -73.98 -32.36 63.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.589 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.509 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 10.2 t -76.02 -36.72 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.864 0.364 . . . . 0.0 111.091 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -54.9 -46.05 74.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.123 179.106 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.416 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.2 OUTLIER -64.25 -26.15 68.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.793 179.486 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.509 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 18.0 m-30 -72.02 -36.31 69.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.141 179.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.527 ' CD1' ' HB3' ' A' ' 500' ' ' LEU . 1.3 mt -75.33 -59.39 2.77 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.186 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -46.11 -27.41 0.95 Allowed 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.555 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -85.77 -52.85 5.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.784 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.45 ' HG3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -167.57 135.4 1.96 Allowed Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.575 -179.756 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.606 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 33.2 Cg_exo -53.74 176.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.014 1.809 . . . . 0.0 113.02 -179.19 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.508 ' HE2' ' CD1' ' A' ' 513' ' ' PHE . 0.0 OUTLIER -164.73 171.76 13.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.878 -177.439 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.504 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 1.4 p -112.21 157.95 20.28 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 177.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.416 ' CG2' HD23 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -59.17 -39.98 84.18 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.24 -0.584 . . . . 0.0 110.569 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.497 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -65.74 -50.91 63.07 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.765 178.942 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -62.9 -22.21 66.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.418 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.478 ' CD2' ' HG2' ' A' ' 468' ' ' MET . 10.7 mt -76.65 -46.26 26.56 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.434 HD22 ' CD1' ' B' ' 590' ' ' LEU . 0.5 OUTLIER -73.27 -50.7 20.82 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.761 0.315 . . . . 0.0 111.199 -179.169 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.497 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 23.8 mmtt -52.11 -25.19 8.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.185 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.604 ' HE2' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -70.47 -43.99 68.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.853 0.358 . . . . 0.0 110.499 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.604 ' CD2' ' HE2' ' A' ' 476' ' ' LYS . 15.5 m-85 -69.95 -55.22 10.23 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.867 0.842 . . . . 0.0 109.874 179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 50.61 174.44 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.011 -1.45 . . . . 0.0 111.452 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 1.2 m -80.79 3.11 23.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.315 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 20.4 tptt -48.46 -44.07 35.18 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.574 0.226 . . . . 0.0 111.577 -179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.6 -45.94 0.89 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.648 0.261 . . . . 0.0 111.521 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 482' ' ' THR . . . . . . . . . . . . . 13.9 p -53.92 -16.51 1.88 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.161 179.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 61.84 20.4 59.77 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.453 -0.88 . . . . 0.0 111.131 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.415 ' CD2' ' CG1' ' A' ' 492' ' ' VAL . 0.3 OUTLIER -105.59 121.93 44.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 120.996 0.427 . . . . 0.0 111.366 -179.32 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.13 161.13 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.589 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 23.4 p -60.18 -25.15 65.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.077 0.465 . . . . 0.0 109.951 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -90.45 -46.3 8.43 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.422 179.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.21 -41.95 98.84 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.889 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.496 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 88.6 m -50.76 -29.31 11.15 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.93 -41.14 16.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.293 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.58 -28.21 65.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.321 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.472 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 4.4 p -101.58 -7.57 9.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.957 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.497 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 3.4 tp -95.11 -35.89 11.72 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.943 0.402 . . . . 0.0 110.784 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.479 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -58.92 -38.99 80.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.175 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.472 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -66.64 -41.6 88.02 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.825 -179.338 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.504 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 12.7 mt -81.05 -30.07 11.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.497 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.0 OUTLIER -49.36 -56.93 7.91 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -178.622 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.472 ' N ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -61.86 -28.94 69.85 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -177.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.476 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 16.7 mmm180 -55.05 -22.16 14.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.059 0.457 . . . . 0.0 110.714 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.527 ' HB3' ' CD1' ' A' ' 463' ' ' LEU . 50.0 mt -63.15 -48.01 80.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.291 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.597 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.9 t-20 55.18 57.36 11.04 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.898 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.597 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 58.2 Cg_endo -100.36 -160.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.222 0 C-N-CA 124.083 3.189 . . . . 0.0 111.66 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.47 140.33 51.57 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.705 178.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -79.55 135.69 36.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.377 0.608 . . . . 0.0 111.535 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -154.69 147.46 24.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.747 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 6.9 ptm -90.14 108.77 19.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.011 0.434 . . . . 0.0 111.77 -179.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.417 HG12 ' HB2' ' A' ' 512' ' ' HIS . 0.6 OUTLIER -92.7 110.77 23.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.884 178.872 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 59.63 40.39 20.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.932 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 77.11 10.31 2.55 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.524 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.437 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.6 tpmt? -116.09 131.83 56.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.594 0.235 . . . . 0.0 110.679 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 6.6 tpt -66.61 108.42 2.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.119 0.485 . . . . 0.0 111.052 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.504 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 12.1 m170 -122.74 137.9 54.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.225 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.519 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -118.54 122.97 43.95 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.698 0.285 . . . . 0.0 110.721 179.652 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.606 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -168.95 169.8 9.42 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.196 0.522 . . . . 0.0 111.993 -179.302 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.494 HD21 ' HB2' ' A' ' 463' ' ' LEU . 1.3 pt? -111.01 169.09 9.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.401 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -135.37 106.65 6.78 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.389 -0.524 . . . . 0.0 111.59 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.105 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.811 0.339 . . . . 0.0 111.182 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -61.0 86.32 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.915 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . 0.435 ' O ' ' OD1' ' B' ' 588' ' ' ASP . 3.5 p-10 -86.72 49.14 1.75 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 121.003 0.43 . . . . 0.0 110.872 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.423 ' O ' ' NE2' ' B' ' 589' ' ' HIS . 12.0 pt-20 -87.32 -35.15 18.57 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.326 0.584 . . . . 0.0 110.793 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -84.14 -22.5 31.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.56 -178.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' B' ' 585' ' ' ASP . 39.0 p-10 -50.75 -51.53 49.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.879 0.371 . . . . 0.0 111.843 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.423 ' NE2' ' O ' ' B' ' 586' ' ' GLU . 1.8 p-80 -80.52 -21.96 41.36 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.327 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.585 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 31.6 tp -54.69 -33.86 61.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.007 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . 0.419 HG23 HD13 ' B' ' 591' ' ' ILE . 83.2 mt -85.85 -29.62 6.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.896 0.379 . . . . 0.0 110.818 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.19 -40.72 96.7 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.382 -179.818 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.585 ' CD1' ' O ' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -78.91 -18.11 54.41 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.107 0.48 . . . . 0.0 110.211 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.439 ' HA ' HG21 ' A' ' 470' ' ' THR . 79.8 tt0 -62.78 -32.66 73.86 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.001 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.467 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 8.0 pt-20 -79.5 -47.43 15.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.355 -179.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.573 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.0 pp -51.45 -26.7 6.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 120.965 0.412 . . . . 0.0 111.276 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.66 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.8 tp -69.87 -83.04 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.492 0.663 . . . . 0.0 111.435 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.66 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m -141.77 30.19 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.083 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.527 -178.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 4.6 mtp-105 -139.06 40.19 2.12 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.166 -179.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.2 p . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.092 179.965 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.831 0.348 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 45.8 t -60.59 158.64 2.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.085 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -139.12 140.3 37.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.734 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.474 ' CG2' ' CG ' ' A' ' 477' ' ' PHE . 2.3 t -87.5 104.83 14.68 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.036 0.446 . . . . 0.0 111.126 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 455' ' ' THR . . . . . 0.411 ' O ' HG21 ' A' ' 459' ' ' VAL . 28.4 p -132.1 163.0 29.44 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.516 0.674 . . . . 0.0 112.285 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.553 ' O ' ' HG2' ' A' ' 460' ' ' ARG . 15.9 mt-10 -59.35 -54.53 45.74 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.126 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -28.25 19.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.777 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.429 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -77.65 -35.42 52.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.777 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.47 HG11 HD21 ' A' ' 473' ' ' LEU . 6.1 t -76.18 -34.85 26.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.684 0.278 . . . . 0.0 111.743 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.2 mmm180 -59.82 -37.22 78.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.643 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.3 OUTLIER -68.95 -31.75 70.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.138 179.313 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.478 ' O ' ' O ' ' A' ' 466' ' ' LYS . 14.7 m-30 -62.17 -45.01 95.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.095 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' A' ' 500' ' ' LEU . 0.3 OUTLIER -65.9 -59.23 4.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.09 179.774 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -49.24 -25.26 2.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.032 0.444 . . . . 0.0 110.424 179.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.566 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 45.5 ttt180 -90.98 -31.19 16.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.134 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.644 ' HE2' ' HD3' ' A' ' 467' ' ' PRO . 0.0 OUTLIER 167.15 167.91 0.11 Allowed Pre-proline 0 CA--C 1.532 0.253 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.592 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.754 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 84.5 Cg_endo -74.43 160.87 41.15 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.283 1.989 . . . . 0.0 114.113 -178.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -150.56 159.33 44.57 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 114.999 -1.001 . . . . 0.0 111.005 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.529 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 17.4 p -108.45 163.41 13.24 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.439 HG21 ' HA ' ' B' ' 594' ' ' GLU . 0.7 OUTLIER -64.63 -36.76 85.29 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.672 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.41 ' HA ' ' CD1' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -72.97 -50.22 24.61 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.42 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -61.12 -26.2 67.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.474 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.47 HD21 HG11 ' A' ' 459' ' ' VAL . 0.4 OUTLIER -69.1 -46.56 67.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.027 0.441 . . . . 0.0 111.152 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.427 ' CD2' ' CD1' ' B' ' 590' ' ' LEU . 2.1 pp -84.19 -31.87 24.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.589 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.52 -29.69 2.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.84 0.352 . . . . 0.0 110.922 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.457 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -93.12 -35.17 13.33 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.929 179.625 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.474 ' CG ' ' CG2' ' A' ' 454' ' ' VAL . 12.2 m-85 -73.46 4.41 4.84 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -47.19 174.12 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.014 0.435 . . . . 0.0 111.548 -179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.66 -7.51 15.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.871 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -42.97 -30.93 0.45 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.715 0.293 . . . . 0.0 111.574 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -155.64 -42.03 0.08 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.345 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 482' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.12 -15.94 2.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.211 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 63.09 19.04 61.02 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.48 -0.867 . . . . 0.0 111.578 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 6.1 tp -114.07 119.58 37.63 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 120.967 0.413 . . . . 0.0 110.983 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.37 145.81 0.16 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.888 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 3.1 t -58.29 -22.56 53.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.726 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -91.52 -48.75 6.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.716 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.05 -38.7 92.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.872 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.408 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 96.7 m -51.69 -30.08 20.64 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . 0.479 ' HA ' ' HB3' ' A' ' 493' ' ' LEU . 4.6 t -82.72 -40.07 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.087 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -60.53 -29.99 69.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.057 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.507 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 4.3 p -100.59 -6.98 9.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.94 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.532 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 16.7 tp -93.61 -40.17 10.42 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.073 0.463 . . . . 0.0 110.373 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.474 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -53.96 -42.12 68.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.381 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.507 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -62.47 -40.16 95.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.975 -179.328 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.482 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 10.2 mt -78.52 -41.67 25.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 112.559 0.578 . . . . 0.0 112.559 -178.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.532 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.0 OUTLIER -37.66 -58.73 0.86 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.524 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.471 ' H ' ' HD2' ' A' ' 498' ' ' LYS . 0.0 OUTLIER -59.44 -22.98 62.28 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.369 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.446 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 0.8 OUTLIER -63.56 -18.75 64.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 0.0 110.457 179.133 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.622 ' HB3' HD11 ' A' ' 463' ' ' LEU . 34.0 mt -62.69 -47.78 82.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.434 -179.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.638 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 28.0 t-20 55.22 54.52 9.94 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.197 -179.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.638 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 61.2 Cg_endo -101.72 -161.0 0.04 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 124.209 3.272 . . . . 0.0 111.712 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.76 139.87 51.62 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.565 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 30.1 ptt180 -79.53 132.45 36.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.451 0.643 . . . . 0.0 111.553 -178.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -156.27 130.07 8.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.841 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -76.47 112.29 12.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.908 0.385 . . . . 0.0 111.535 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.43 ' HB ' ' ND1' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.52 122.54 42.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.655 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . 0.404 ' O ' ' CB ' ' A' ' 509' ' ' ASP . 18.6 p30 48.91 37.56 10.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.436 -179.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . 0.404 ' CB ' ' O ' ' A' ' 508' ' ' ASN . 12.6 t70 80.12 13.03 0.97 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.563 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.435 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -116.28 131.48 56.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.594 179.715 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.05 108.29 1.02 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.087 0.47 . . . . 0.0 110.635 -179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.536 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 28.6 m80 -123.26 127.87 49.19 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.861 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.483 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.0 OUTLIER -104.92 123.73 48.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.803 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.754 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -178.33 169.47 1.82 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.407 0.622 . . . . 0.0 112.276 -178.756 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.546 ' CD2' ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -122.82 168.96 11.6 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.337 178.56 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.474 ' N ' HD21 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -129.97 106.06 8.4 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.207 0.527 . . . . 0.0 111.178 179.644 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.178 -0.915 . . . . 0.0 111.0 179.995 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.864 0.364 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -60.91 86.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . 0.41 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 17.5 t70 -89.97 49.44 1.71 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.974 0.416 . . . . 0.0 110.696 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.485 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 15.1 pt-20 -86.42 -36.37 19.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.975 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.32 -22.88 30.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.875 -179.121 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -53.96 -55.11 30.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.008 0.432 . . . . 0.0 111.601 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.485 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.2 p-80 -77.49 -21.91 52.06 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.041 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.544 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 26.3 tp -58.47 -37.94 76.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.733 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 64.7 mt -86.01 -29.81 6.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.905 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.571 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.32 -40.83 86.0 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-O 121.063 0.459 . . . . 0.0 110.992 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.683 ' O ' HG13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -80.14 -18.16 50.55 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.957 179.781 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.408 ' O ' ' HB2' ' B' ' 599' ' ' ARG . 0.1 OUTLIER -63.41 -32.5 73.95 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.614 179.605 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.469 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 7.7 pt-20 -78.93 -46.87 17.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.385 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.683 HG13 ' O ' ' B' ' 593' ' ' LEU . 1.6 pp -50.76 -26.63 4.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.09 0.471 . . . . 0.0 110.911 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.663 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 14.2 tp -71.65 -82.58 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.618 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.663 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -142.8 30.9 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-N 114.59 -1.187 . . . . 0.0 110.66 -177.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.469 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.2 OUTLIER -139.35 43.28 2.02 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.209 -179.693 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 31.4 m . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.119 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.784 0.326 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 9.1 p -60.62 154.92 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.058 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -128.08 134.72 49.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.923 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.433 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.3 t -60.75 118.52 3.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.682 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 33.4 p -131.67 172.89 11.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.704 0.764 . . . . 0.0 112.489 -179.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.506 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 18.2 mt-10 -69.18 -53.26 20.93 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.463 179.237 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -28.46 64.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.955 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.442 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -70.55 -34.34 72.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.569 -179.507 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.469 ' HB ' HD21 ' A' ' 500' ' ' LEU . 18.6 t -76.15 -37.46 32.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.768 0.318 . . . . 0.0 111.369 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.7 mmm-85 -54.49 -44.57 72.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.073 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.481 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -62.83 -29.25 70.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.446 179.4 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.481 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 10.5 m-30 -68.94 -44.63 72.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.114 0.483 . . . . 0.0 109.909 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.49 ' CD1' HD21 ' A' ' 515' ' ' LEU . 0.7 OUTLIER -67.31 -59.78 3.13 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.224 -179.858 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 17.9 p -47.34 -27.38 1.59 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.009 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.4 mtp85 -88.68 -40.76 13.04 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.015 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.48 ' HD2' ' O ' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -175.96 146.39 0.82 Allowed Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.913 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.694 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 39.9 Cg_endo -65.02 151.76 84.68 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.66 2.24 . . . . 0.0 113.115 -179.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.456 ' HE3' ' CD1' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -147.7 163.83 35.46 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.338 0.589 . . . . 0.0 112.072 -179.317 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.492 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 3.0 p -107.62 160.68 15.51 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.177 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.418 HG23 ' CD2' ' B' ' 593' ' ' LEU . 0.2 OUTLIER -53.26 -46.65 69.31 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.865 -179.641 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.441 ' HG2' ' CD2' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -58.97 -57.02 14.91 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.03 179.287 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -60.57 -26.73 67.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.759 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.456 ' CD1' ' HE3' ' A' ' 468' ' ' MET . 1.5 tt -77.92 -43.9 28.59 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.02 0.438 . . . . 0.0 111.498 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 2.9 pp -84.07 -32.9 24.55 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.251 -179.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.413 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.1 OUTLIER -50.54 -33.4 21.53 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.801 0.334 . . . . 0.0 111.433 -179.428 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.417 ' HE2' ' CE2' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -75.21 -42.02 56.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.338 -179.681 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.433 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.4 m-85 -63.96 -31.2 72.3 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.035 0.445 . . . . 0.0 110.997 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -62.13 113.95 3.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.915 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 3.0 m 74.47 3.28 4.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.496 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -50.38 70.67 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.816 0.341 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 174.74 -30.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.154 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 482' ' ' THR . . . . . . . . . . . . . 10.5 p -51.86 -21.24 2.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.072 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 66.83 15.18 64.22 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.547 -0.835 . . . . 0.0 111.98 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -88.48 129.34 35.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.98 0.419 . . . . 0.0 111.001 -179.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.22 149.92 0.47 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.561 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -58.47 -23.31 57.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.176 178.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . 0.419 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 15.5 mt-10 -86.53 -55.06 4.05 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.613 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -60.0 -40.72 90.19 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.241 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.407 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 97.7 m -50.55 -33.37 21.53 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 4.5 t -76.82 -42.68 33.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.873 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -57.19 -25.97 59.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.391 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.526 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 8.0 p -100.57 -14.92 7.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.266 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.416 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 0.2 OUTLIER -91.36 -32.32 15.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.009 0.433 . . . . 0.0 110.462 179.893 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.487 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -59.3 -39.84 84.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.8 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.526 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.5 OUTLIER -65.88 -41.4 91.61 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.679 -179.59 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.514 ' HA ' ' HG2' ' A' ' 499' ' ' ARG . 8.8 mt -78.42 -32.29 16.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.423 ' HB3' ' CD1' ' B' ' 597' ' ' LEU . 1.1 mm? -49.89 -49.85 48.09 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 -178.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.457 ' N ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -66.49 -29.07 69.09 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.194 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.514 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.4 mmm180 -58.22 -21.69 48.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.992 0.425 . . . . 0.0 110.453 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.469 HD21 ' HB ' ' A' ' 459' ' ' VAL . 37.9 mt -60.74 -47.45 86.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.858 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.572 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.0 t-20 56.33 58.56 9.04 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.6 -179.058 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.572 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 95.5 Cg_endo -100.91 -158.95 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 124.027 3.151 . . . . 0.0 111.391 -179.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.92 139.98 52.48 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.756 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.47 134.24 36.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.381 0.61 . . . . 0.0 111.407 -178.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -156.12 160.16 39.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.717 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.83 109.36 21.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.901 0.381 . . . . 0.0 111.591 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.494 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.67 110.91 22.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.92 179.072 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 59.58 43.21 16.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.697 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 72.93 12.38 5.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.337 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.435 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.7 tpmt? -116.12 132.8 56.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.634 0.254 . . . . 0.0 110.918 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.23 108.8 1.67 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.999 0.428 . . . . 0.0 110.715 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.494 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 15.9 m80 -122.64 124.87 44.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.034 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.484 ' CE1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -105.65 123.81 48.54 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.565 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.694 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -178.81 169.18 1.65 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.162 0.506 . . . . 0.0 112.153 -178.52 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.518 HD22 ' N ' ' A' ' 515' ' ' LEU . 1.5 pt? -118.95 169.23 10.06 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.452 179.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.402 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -139.78 106.31 5.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.994 0.426 . . . . 0.0 111.33 179.606 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.907 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.755 0.312 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -62.54 83.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.967 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . 0.417 ' HA ' ' OD2' ' B' ' 588' ' ' ASP . 10.2 t70 -90.04 49.22 1.67 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.005 0.431 . . . . 0.0 110.514 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.481 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 13.5 pt-20 -87.29 -51.89 5.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.035 -0.529 . . . . 0.0 112.025 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' B' ' 590' ' ' LEU . 0.6 OUTLIER -84.91 -33.08 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -177.932 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . 0.417 ' OD2' ' HA ' ' B' ' 585' ' ' ASP . 6.8 p30 -58.24 -39.68 79.77 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.509 ' HD2' ' N ' ' B' ' 590' ' ' LEU . 1.0 OUTLIER -80.03 -21.0 44.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.528 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.525 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 17.3 tp -48.43 -29.82 4.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.024 0.44 . . . . 0.0 110.624 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 72.8 mt -85.58 -29.55 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.623 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.586 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.35 -42.83 99.34 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.433 -179.705 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.638 ' O ' HG13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -78.58 -17.71 55.7 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.225 0.536 . . . . 0.0 109.845 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.4 ' O ' ' HB2' ' B' ' 599' ' ' ARG . 0.4 OUTLIER -63.15 -33.8 76.25 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.671 179.686 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.478 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 7.1 pt-20 -78.6 -46.99 18.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.636 -178.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.638 HG13 ' O ' ' B' ' 593' ' ' LEU . 1.5 pp -49.79 -26.68 2.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.101 0.477 . . . . 0.0 111.124 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.661 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.4 tp -72.32 -82.44 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.68 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.661 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.9 m -142.27 30.31 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.774 -177.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.478 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.2 OUTLIER -139.02 39.31 2.13 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.272 -179.579 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.087 179.939 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.864 0.364 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 11.0 m -155.22 -168.95 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.886 179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.13 121.35 6.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 110.68 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.449 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.5 t -78.58 109.7 13.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.917 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 32.2 p -131.83 168.07 18.47 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.65 0.738 . . . . 0.0 112.233 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.494 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 23.6 mt-10 -62.53 -52.96 61.39 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.315 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -28.46 68.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.251 -179.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.458 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -67.68 -38.14 83.3 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.863 0.363 . . . . 0.0 111.322 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.446 HG13 HD22 ' A' ' 500' ' ' LEU . 21.0 t -72.38 -32.86 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.947 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.5 OUTLIER -56.61 -49.61 74.44 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 178.636 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.458 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -59.01 -25.02 63.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.727 179.543 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.441 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 14.7 m-30 -73.17 -46.54 50.16 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.108 0.48 . . . . 0.0 109.734 178.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.508 ' CD1' HD22 ' A' ' 515' ' ' LEU . 0.6 OUTLIER -65.72 -57.91 6.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.233 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 464' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 460' ' ' ARG . 0.0 OUTLIER -48.26 -27.76 2.67 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.087 0.47 . . . . 0.0 110.506 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . 0.561 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 31.0 ttt85 -87.98 -32.64 18.74 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.806 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.561 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER 169.29 153.15 0.15 Allowed Pre-proline 0 CA--C 1.53 0.21 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.746 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.706 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 40.3 Cg_endo -64.96 165.45 21.42 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.64 2.227 . . . . 0.0 113.595 -179.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.502 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -159.46 152.78 22.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.407 -179.125 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.503 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 12.3 p -96.82 155.87 16.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.496 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.0 OUTLIER -51.02 -45.86 61.4 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.888 -179.662 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.433 ' HG2' ' CD2' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -59.37 -53.73 54.87 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.033 178.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -61.43 -33.41 73.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.625 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.502 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 0.9 OUTLIER -71.01 -41.39 70.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.981 0.42 . . . . 0.0 111.5 -179.583 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.477 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 2.4 pp -84.39 -34.77 23.5 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.997 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.429 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -48.96 -31.81 8.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.716 0.293 . . . . 0.0 111.413 -179.385 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.47 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -81.14 -33.84 32.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.238 -179.871 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.47 ' CE2' ' HE2' ' A' ' 476' ' ' LYS . 15.1 m-85 -74.86 6.81 3.64 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -46.47 171.34 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.904 0.383 . . . . 0.0 111.51 -179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 2.8 t -66.04 -5.17 8.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.07 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.21 -30.61 0.5 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.605 0.24 . . . . 0.0 111.585 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.0 -45.24 0.2 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.815 0.34 . . . . 0.0 111.398 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 482' ' ' THR . . . . . . . . . . . . . 10.8 p -59.11 -13.84 8.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.284 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 60.05 21.07 55.46 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.115 -1.04 . . . . 0.0 110.507 -178.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 19.2 tp -111.57 119.58 39.19 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.082 -0.559 . . . . 0.0 111.09 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.86 143.87 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.789 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.88 -22.07 61.85 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.97 0.414 . . . . 0.0 110.002 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -82.69 -52.83 6.42 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.778 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -63.5 -38.79 92.47 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.978 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 93.0 m -51.45 -30.38 19.41 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 4.2 t -79.09 -43.15 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.032 179.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -57.12 -25.93 59.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.602 179.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.506 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.6 p -100.85 -13.83 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.307 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.517 ' CD1' ' CD2' ' A' ' 497' ' ' LEU . 0.5 OUTLIER -89.33 -37.07 15.17 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.086 0.469 . . . . 0.0 110.452 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.466 ' HB2' ' CD1' ' B' ' 596' ' ' ILE . . . -55.32 -40.22 70.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.386 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.506 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -63.99 -41.27 97.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.156 -179.171 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.494 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 9.4 mt -75.08 -45.84 41.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.517 ' CD2' ' CD1' ' A' ' 493' ' ' LEU . 3.2 mm? -36.3 -59.79 0.61 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.493 ' N ' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.81 -30.16 68.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.774 0.321 . . . . 0.0 111.809 -178.85 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.41 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 1.2 tpt180 -60.29 -24.34 64.88 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.957 0.408 . . . . 0.0 110.75 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.457 ' CD1' HD12 ' A' ' 463' ' ' LEU . 52.2 mt -61.07 -47.22 87.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.69 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.566 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 50.2 t-20 58.45 59.12 6.1 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.962 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.566 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 71.5 Cg_endo -101.56 -160.1 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 124.045 3.164 . . . . 0.0 111.441 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.82 139.4 53.2 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 505' ' ' LYS . 7.9 ptt85 -79.69 131.54 35.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.482 0.658 . . . . 0.0 111.758 -178.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' A' ' 504' ' ' ARG . 0.1 OUTLIER -148.26 160.13 43.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.406 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 506' ' ' MET . . . . . 0.402 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 7.2 ptm -105.03 108.84 20.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.92 0.391 . . . . 0.0 111.295 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.496 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.59 110.88 22.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.011 179.274 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 59.7 41.65 18.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.793 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.9 t0 73.95 13.85 4.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.209 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.443 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.11 132.01 56.78 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.926 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.15 108.7 1.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.095 0.474 . . . . 0.0 110.658 179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.536 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 19.7 m80 -122.8 127.12 48.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.107 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.463 ' CD1' ' CD2' ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.54 123.91 48.81 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.646 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.706 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -177.52 169.39 2.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.254 0.55 . . . . 0.0 112.441 -178.66 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.531 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.4 pt? -117.4 169.18 9.71 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.213 -0.903 . . . . 0.0 108.942 178.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . 0.429 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -138.0 106.45 5.82 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.479 179.787 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.761 179.948 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.792 0.33 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -61.13 85.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.866 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . 0.412 ' O ' ' OD1' ' B' ' 588' ' ' ASP . 5.5 p-10 -86.66 49.04 1.73 Allowed 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 120.918 0.389 . . . . 0.0 110.761 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.433 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.4 pt-20 -87.09 -31.31 20.53 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.282 0.563 . . . . 0.0 110.658 178.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -84.05 -22.45 31.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.392 -178.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . 0.429 ' OD1' ' N ' ' B' ' 589' ' ' HIS . 14.5 p-10 -50.7 -50.26 55.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.883 0.373 . . . . 0.0 111.874 -178.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.433 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.0 OUTLIER -80.53 -23.72 39.83 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.353 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.539 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 24.9 tp -55.15 -35.76 65.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.971 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 67.7 mt -85.88 -29.72 6.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.901 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.539 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.79 -42.62 81.36 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.474 -179.686 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.558 ' C ' ' CD2' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -75.33 -22.16 57.84 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.2 0.524 . . . . 0.0 109.925 179.559 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' B' ' 599' ' ' ARG . 72.4 tt0 -63.32 -30.87 71.93 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.888 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.43 ' HG3' ' N ' ' B' ' 596' ' ' ILE . 0.0 OUTLIER -76.89 -36.88 56.38 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.362 -179.038 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.475 HD11 ' HB2' ' A' ' 494' ' ' ALA . 4.0 pt -61.4 -26.54 39.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.114 0.483 . . . . 0.0 111.183 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.653 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 13.6 tp -72.83 -81.86 0.05 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.03 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.653 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.2 m -141.41 30.38 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.724 -177.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' B' ' 594' ' ' GLU . 0.6 OUTLIER -137.46 38.87 2.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.251 -179.746 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.1 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.147 179.921 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.871 0.367 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . 0.41 ' CG1' HG23 ' A' ' 482' ' ' THR . 8.7 p -170.27 159.49 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.119 179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -133.87 140.5 46.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.915 -179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.448 HG23 ' CD2' ' A' ' 477' ' ' PHE . 3.4 t -71.76 110.96 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.339 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 30.4 p -131.84 167.32 19.77 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.665 0.745 . . . . 0.0 112.449 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.538 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 19.2 mt-10 -63.04 -53.47 53.25 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 114.561 -1.199 . . . . 0.0 110.505 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.37 -28.28 65.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.88 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.438 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -72.63 -34.31 67.22 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.779 -179.462 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.466 ' HA ' ' CD2' ' A' ' 462' ' ' TYR . 18.3 t -75.97 -36.77 32.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.476 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.5 OUTLIER -54.51 -45.46 73.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.932 0.396 . . . . 0.0 110.131 179.135 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.482 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -62.16 -29.31 70.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.891 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.482 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 10.7 m-30 -68.3 -44.13 76.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.072 0.463 . . . . 0.0 110.178 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.48 HD11 ' CD1' ' A' ' 500' ' ' LEU . 0.5 OUTLIER -67.24 -59.25 3.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.305 -179.657 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -49.58 -26.25 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.99 0.424 . . . . 0.0 110.572 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -90.07 -46.22 8.63 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.009 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.514 ' HE2' ' HG2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -171.78 131.02 0.73 Allowed Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.916 -179.584 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.652 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 10.7 Cg_endo -52.51 163.25 1.86 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.366 2.044 . . . . 0.0 112.405 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.597 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -157.39 159.12 37.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.245 0.545 . . . . 0.0 112.102 -178.609 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.499 ' CG2' ' CE1' ' A' ' 512' ' ' HIS . 5.1 p -102.54 155.59 18.17 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.161 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.515 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -51.77 -43.98 63.2 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.859 -179.485 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.548 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -60.54 -58.81 6.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.284 0.564 . . . . 0.0 109.735 178.855 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.16 -20.28 39.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.498 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.597 ' HG ' ' HG3' ' A' ' 468' ' ' MET . 0.5 OUTLIER -87.57 -40.76 13.98 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.887 0.375 . . . . 0.0 111.702 -179.575 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.432 ' HB3' ' CD2' ' A' ' 493' ' ' LEU . 1.3 pp -84.03 -49.73 8.65 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.504 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 18.3 mmtp -48.72 -25.34 1.76 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.76 0.314 . . . . 0.0 111.475 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.472 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -81.55 -43.59 18.52 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.722 179.818 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.472 ' CE2' ' HE2' ' A' ' 476' ' ' LYS . 8.3 m-85 -59.95 -30.13 68.88 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.092 0.473 . . . . 0.0 110.938 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -79.12 129.04 34.04 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.264 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -176.48 -77.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.721 179.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 4.2 tptt -177.77 22.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.702 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 14.2 mmtt -109.08 -71.36 0.77 Allowed 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.64 0.257 . . . . 0.0 111.516 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 482' ' ' THR . . . . . 0.41 HG23 ' CG1' ' A' ' 452' ' ' VAL . 21.0 p -53.22 -12.63 0.41 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.277 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 62.41 20.73 61.47 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 110.561 -1.015 . . . . 0.0 110.561 -178.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 1.3 tp -103.07 123.57 46.9 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.02 -0.59 . . . . 0.0 111.503 -179.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.14 154.95 0.33 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.401 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 5.1 p -61.25 -26.3 67.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.515 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -90.73 -42.34 10.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.611 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -65.73 -40.99 92.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.092 179.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.452 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 89.5 m -50.28 -29.42 9.63 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . . . . . . . . . 10.1 t -82.66 -40.85 17.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.004 179.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -58.34 -28.2 64.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.389 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.459 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 4.0 p -102.15 -8.89 9.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.384 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.497 ' CD1' ' CD2' ' A' ' 497' ' ' LEU . 2.3 tp -93.31 -40.59 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.043 0.449 . . . . 0.0 110.908 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.475 ' HB2' HD11 ' B' ' 596' ' ' ILE . . . -53.26 -45.23 68.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.279 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.459 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -58.84 -35.99 73.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.001 -179.447 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.538 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 8.6 mt -81.94 -32.25 11.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.515 ' HG ' ' CG2' ' A' ' 470' ' ' THR . 3.5 mm? -50.98 -48.37 61.2 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.478 ' N ' HD11 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -62.02 -32.44 72.93 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -178.72 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.505 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 0.9 OUTLIER -57.74 -23.44 52.06 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.954 0.407 . . . . 0.0 110.526 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.48 ' CD1' HD11 ' A' ' 463' ' ' LEU . 50.8 mt -59.92 -47.36 86.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.698 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.583 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.0 t-20 55.91 57.96 9.79 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.44 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.583 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 87.9 Cg_endo -101.38 -160.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 123.879 3.052 . . . . 0.0 111.485 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.61 141.15 48.87 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.625 178.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -79.42 133.66 36.55 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.396 0.617 . . . . 0.0 111.368 -178.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -156.15 160.13 39.63 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.842 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -105.16 110.27 22.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.902 0.382 . . . . 0.0 111.509 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.531 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.65 110.92 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.781 178.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.5 44.27 15.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.74 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 71.72 13.04 6.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.318 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.445 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.7 tpmt? -116.17 132.03 56.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.644 -0.253 . . . . 0.0 110.886 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.3 108.66 1.35 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.993 0.425 . . . . 0.0 110.589 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.531 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 16.5 m80 -122.68 125.29 45.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.248 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.473 ' CE1' HD22 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -105.22 123.55 48.02 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.516 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.652 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -177.98 169.38 1.97 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.151 0.501 . . . . 0.0 112.21 -178.896 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.509 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.3 pt? -116.57 169.16 9.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.286 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.45 106.43 6.65 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.026 0.441 . . . . 0.0 111.35 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.121 179.923 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.785 0.326 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -60.4 94.36 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.934 179.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 584' ' ' TPO . . . . . 0.483 ' O3P' ' CG2' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 585' ' ' ASP . . . . . 0.405 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 3.4 t70 -90.03 49.27 1.68 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.962 0.41 . . . . 0.0 110.644 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 586' ' ' GLU . . . . . 0.469 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 17.9 pt-20 -86.34 -41.37 14.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.599 179.381 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.26 -22.7 30.68 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.532 -179.432 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -51.02 -55.0 19.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.069 0.461 . . . . 0.0 111.611 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 589' ' ' HIS . . . . . 0.469 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.2 p-80 -79.57 -21.82 44.59 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.205 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 590' ' ' LEU . . . . . 0.628 ' O ' ' CD1' ' B' ' 593' ' ' LEU . 37.9 tp -52.68 -29.56 27.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.937 0.399 . . . . 0.0 111.05 -179.936 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 97.3 mt -85.41 -29.5 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 CA-C-O 120.975 0.417 . . . . 0.0 110.786 -179.892 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 592' ' ' TYR . . . . . 0.6 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.91 -45.61 85.16 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.849 -179.507 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 593' ' ' LEU . . . . . 0.628 ' CD1' ' O ' ' B' ' 590' ' ' LEU . 0.0 OUTLIER -70.02 -18.22 63.3 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.972 0.415 . . . . 0.0 110.373 -179.704 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 594' ' ' GLU . . . . . 0.479 ' HA ' HG21 ' A' ' 470' ' ' THR . 62.5 tt0 -62.8 -30.79 71.74 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 120.853 0.358 . . . . 0.0 110.913 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 595' ' ' GLU . . . . . 0.423 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.3 OUTLIER -80.19 -46.2 16.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.038 -179.343 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 596' ' ' ILE . . . . . 0.55 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.3 pp -54.91 -26.54 17.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.944 0.402 . . . . 0.0 111.147 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 597' ' ' LEU . . . . . 0.657 ' HG ' ' N ' ' B' ' 598' ' ' VAL . 14.8 tp -69.17 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.436 0.636 . . . . 0.0 111.833 179.996 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 598' ' ' VAL . . . . . 0.657 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.5 m -140.77 30.02 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.593 -177.8 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 599' ' ' ARG . . . . . 0.423 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 10.4 mtp85 -139.84 39.0 1.99 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.171 -179.576 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 30.3 m . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.115 179.965 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.891 0.377 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 41.3 t 60.39 154.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.394 179.945 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.71 128.43 7.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.329 179.467 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.461 HG23 ' CD2' ' A' ' 477' ' ' PHE . 62.6 t -74.19 104.76 2.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.575 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 455' ' ' THR . . . . . 0.406 ' O ' HG23 ' A' ' 459' ' ' VAL . 16.9 p -131.68 158.29 41.49 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.552 0.691 . . . . 0.0 112.483 -179.336 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 456' ' ' GLU . . . . . 0.525 ' HA ' ' CG2' ' A' ' 496' ' ' ILE . 17.1 mt-10 -50.19 -52.46 35.46 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.655 -1.157 . . . . 0.0 111.171 179.425 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.97 -30.75 71.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.376 -179.196 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 458' ' ' ALA . . . . . 0.454 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -70.52 -56.8 5.7 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.765 0.317 . . . . 0.0 111.461 -179.523 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.518 ' O ' ' HG ' ' A' ' 463' ' ' LEU . 21.0 t -48.84 -26.47 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.711 0.291 . . . . 0.0 111.221 -179.574 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 460' ' ' ARG . . . . . 0.513 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.7 OUTLIER -61.73 -49.78 75.06 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.547 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 461' ' ' ARG . . . . . 0.488 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -57.94 -30.75 66.22 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.402 179.351 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 462' ' ' TYR . . . . . 0.495 ' CE2' ' CE2' ' A' ' 477' ' ' PHE . 8.5 m-30 -64.54 -42.58 95.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.189 0.518 . . . . 0.0 109.739 178.867 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 463' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 459' ' ' VAL . 0.8 OUTLIER -71.84 -57.89 3.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.291 -179.9 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 464' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -47.07 -26.44 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.812 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -91.65 -50.68 5.63 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.116 179.785 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 466' ' ' LYS . . . . . 0.412 ' CE ' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -168.18 132.99 1.47 Allowed Pre-proline 0 N--CA 1.452 -0.352 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.054 -179.774 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 467' ' ' PRO . . . . . 0.556 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 37.1 Cg_exo -57.38 146.71 81.63 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.374 2.049 . . . . 0.0 113.116 -179.606 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 468' ' ' MET . . . . . 0.511 ' SD ' ' CD1' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -128.97 177.14 7.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.968 -179.571 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 469' ' ' THR . . . . . 0.541 ' CG2' ' CD2' ' A' ' 512' ' ' HIS . 1.4 p -115.06 157.16 23.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.919 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 470' ' ' THR . . . . . 0.492 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.6 OUTLIER -54.56 -39.56 67.86 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 120.159 -0.617 . . . . 0.0 110.664 -179.602 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.749 ' O ' ' HG2' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -68.97 -60.39 2.4 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.253 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -52.96 -24.94 10.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.192 179.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 473' ' ' LEU . . . . . 0.553 ' HA ' ' NZ ' ' A' ' 476' ' ' LYS . 0.7 OUTLIER -69.98 -40.1 75.56 Favored 'General case' 0 CA--C 1.523 -0.069 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.526 -179.438 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.434 ' CD2' ' CD1' ' B' ' 590' ' ' LEU . 0.9 OUTLIER -84.78 -25.69 28.04 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -179.499 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 475' ' ' LYS . . . . . 0.749 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 68.6 mmtt -57.68 -44.49 85.82 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -178.828 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 476' ' ' LYS . . . . . 0.553 ' NZ ' ' HA ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -74.39 -43.48 56.21 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.596 179.927 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . 0.553 ' N ' ' HG2' ' A' ' 476' ' ' LYS . 5.1 m-85 -59.35 -59.96 4.62 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.062 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 478' ' ' GLN . . . . . 0.504 ' O ' ' O ' ' A' ' 477' ' ' PHE . 0.1 OUTLIER 43.22 175.0 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 113.705 -1.588 . . . . 0.0 112.697 178.806 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 479' ' ' THR . . . . . 0.43 ' HB ' ' O ' ' A' ' 484' ' ' LEU . 14.5 t -77.42 -28.49 52.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.025 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -56.21 -20.93 20.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.0 -179.305 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -111.99 -76.27 0.6 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 482' ' ' THR . . . . . . . . . . . . . 47.0 p -60.66 -3.23 0.66 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.585 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 63.02 19.96 61.96 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.321 -0.942 . . . . 0.0 111.146 -179.087 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.43 ' O ' ' HB ' ' A' ' 479' ' ' THR . 0.9 OUTLIER -102.42 122.28 43.99 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.504 -0.348 . . . . 0.0 111.098 -179.444 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -39.35 153.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.969 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -60.99 -26.15 67.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.261 179.256 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -88.73 -45.95 9.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.382 179.537 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 488' ' ' GLN . . . . . 0.403 ' HA ' ' HB3' ' A' ' 491' ' ' ASN . 1.5 mt-30 -63.48 -41.08 98.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.921 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 489' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 86.0 m -50.28 -30.51 12.03 Favored 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.637 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 490' ' ' VAL . . . . . 0.424 ' HA ' ' HB3' ' A' ' 493' ' ' LEU . 7.0 t -83.02 -40.43 16.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.001 179.034 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . 0.403 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 5.2 t30 -60.98 -30.87 70.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.938 178.928 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 492' ' ' VAL . . . . . 0.473 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 5.4 p -98.46 -6.85 9.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.887 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.504 ' HG ' ' CD2' ' A' ' 497' ' ' LEU . 19.8 tp -95.27 -42.01 8.76 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.994 0.426 . . . . 0.0 110.61 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . 0.437 ' CB ' ' HB2' ' B' ' 593' ' ' LEU . . . -54.45 -33.8 60.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.507 -179.921 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.473 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -67.84 -42.79 80.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.125 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 496' ' ' ILE . . . . . 0.525 ' CG2' ' HA ' ' A' ' 456' ' ' GLU . 12.9 mt -76.08 -46.89 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 112.368 0.506 . . . . 0.0 112.368 -179.06 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.504 ' CD2' ' HG ' ' A' ' 493' ' ' LEU . 0.0 OUTLIER -32.85 -64.33 0.19 Allowed 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -178.483 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 498' ' ' LYS . . . . . 0.492 ' N ' HD11 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -61.47 -31.64 71.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.907 0.384 . . . . 0.0 111.575 -178.956 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 499' ' ' ARG . . . . . 0.423 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 2.4 tpt180 -57.59 -23.42 50.77 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.961 179.79 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . 0.448 ' CD1' HD13 ' A' ' 463' ' ' LEU . 53.1 mt -62.37 -47.5 83.91 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.819 -179.366 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.584 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 50.9 t-20 56.5 58.31 8.83 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.787 -179.349 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 502' ' ' PRO . . . . . 0.584 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 65.2 Cg_endo -101.2 -158.97 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.338 0 C-N-CA 124.097 3.198 . . . . 0.0 111.536 -179.505 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.15 141.91 47.99 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.76 178.881 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.57 135.49 36.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.282 0.563 . . . . 0.0 111.44 -179.026 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -155.26 157.44 37.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.809 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 7.4 ptm -105.13 108.93 20.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.994 0.426 . . . . 0.0 111.598 -179.728 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 507' ' ' ILE . . . . . 0.417 HG12 ' HB2' ' A' ' 512' ' ' HIS . 1.2 mm -90.94 110.77 22.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.082 179.225 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.7 t30 59.03 40.35 22.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.764 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 2.7 t70 76.62 12.12 2.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.359 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.441 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.6 tpmt? -116.17 130.65 56.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.765 0.317 . . . . 0.0 110.925 179.696 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 45.3 mmm -65.7 108.92 2.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.983 0.421 . . . . 0.0 111.023 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . 0.541 ' CD2' ' CG2' ' A' ' 469' ' ' THR . 15.1 m170 -122.15 135.35 54.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.289 179.512 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 513' ' ' PHE . . . . . 0.549 ' CE2' ' CD2' ' B' ' 597' ' ' LEU . 0.0 OUTLIER -110.55 123.44 49.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.664 0.269 . . . . 0.0 111.08 -179.896 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 514' ' ' SER . . . . . 0.556 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 2.1 m -174.51 169.57 3.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.475 0.655 . . . . 0.0 112.563 -179.691 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 515' ' ' LEU . . . . . 0.492 HD22 ' HB2' ' A' ' 463' ' ' LEU . 1.1 pt? -114.35 169.04 9.33 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.551 178.599 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.42 106.54 7.94 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.507 179.849 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.215 -0.897 . . . . 0.0 111.076 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.28 0 CA-C-O 120.728 0.299 . . . . 2.3199999999999998 111.605 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -51.01 -55.06 19.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.993 0.425 . . . . 1.8899999999999999 111.626 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -79.07 -21.85 46.17 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.749 -0.66 . . . . 0.54000000000000004 111.183 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.931 ' CD1' HD21 ' A' ' 474' ' ' LEU . 28.2 tp -56.44 -33.37 65.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 0.40999999999999998 110.811 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 591' ' ' ILE . . . . . 0.422 HG23 ' OE2' ' B' ' 594' ' ' GLU . 70.1 mt -85.71 -29.71 6.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.267 -0.424 . . . . 0.68999999999999995 110.804 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.571 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.74 -44.32 86.34 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.142 -0.481 . . . . 1.54 111.446 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.789 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -75.22 -17.94 60.23 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.128 0.489 . . . . 0.32000000000000001 110.032 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.644 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.8 OUTLIER -63.17 -30.78 71.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.005 -0.543 . . . . 1.77 110.853 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 3.7 pt-20 -82.87 -43.92 16.02 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.608 0.596 . . . . 1.8500000000000001 112.608 -178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.684 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.6 pp -51.07 -26.61 4.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.059 0.456 . . . . 0.55000000000000004 111.231 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.872 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.2 tp -71.32 -82.7 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.527 0.68 . . . . 0.35999999999999999 111.733 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.698 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.439 -1.005 0 CA-C-N 114.565 -1.198 . . . . 0.44 110.642 -177.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.592 HG22 ' CE2' ' A' ' 477' ' ' PHE . 14.2 t . . . . . 0 CA--C 1.516 -0.335 0 CA-C-O 120.976 0.417 . . . . 0.58999999999999997 110.78 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.479 ' O ' HG23 ' A' ' 459' ' ' VAL . 28.7 p -131.71 165.34 23.95 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.613 0.72 . . . . 0.38 112.424 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.682 ' HA ' HG23 ' A' ' 496' ' ' ILE . 18.2 mt-10 -60.16 -53.23 60.22 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 114.557 -1.201 . . . . 1.25 110.566 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.32 -28.89 68.49 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.261 -0.881 . . . . 1.29 112.162 -179.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.492 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -71.3 -37.68 71.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.453 -0.34 . . . . 0.38 111.734 -179.429 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.776 HG13 HD11 ' A' ' 473' ' ' LEU . 21.9 t -72.52 -32.32 41.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.842 -0.343 . . . . 0.28000000000000003 111.541 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.522 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -58.12 -39.56 79.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.391 -0.368 . . . . 2.2599999999999998 110.429 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -67.12 -29.59 69.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 2.54 110.478 179.816 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 5.0 m-30 -69.27 -39.74 78.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 1.27 110.242 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.946 HD11 HD22 ' A' ' 500' ' ' LEU . 2.0 mt -69.89 -63.67 1.03 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.706 -0.679 . . . . 0.39000000000000001 111.733 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.794 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.62 -26.31 1.45 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 0.54000000000000004 110.929 -179.659 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -88.13 -46.81 8.97 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.896 -0.593 . . . . 3.27 111.221 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.8 OUTLIER -170.06 133.94 1.13 Allowed Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.573 -0.285 . . . . 3.9700000000000002 110.891 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.646 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 13.9 Cg_endo -54.83 156.22 15.81 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.444 2.096 . . . . 0.56999999999999995 112.612 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.731 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.47 163.02 39.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.317 0.58 . . . . 0.92000000000000004 111.899 -179.111 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.684 HG22 ' O ' ' A' ' 511' ' ' MET . 4.3 p -106.11 158.92 16.47 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.819 -1.178 . . . . 0.60999999999999999 107.819 177.136 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.506 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.4 OUTLIER -53.49 -46.62 70.08 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.291 -0.564 . . . . 0.62 110.95 -179.658 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.824 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -59.53 -52.02 67.37 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.885 -0.598 . . . . 1.3200000000000001 110.267 179.171 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -63.61 -32.05 73.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.775 -0.648 . . . . 1.1399999999999999 111.563 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.776 HD11 HG13 ' A' ' 459' ' ' VAL . 0.9 OUTLIER -71.55 -39.39 70.71 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.998 0.428 . . . . 0.95999999999999996 111.354 -179.657 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 1.002 ' HB3' HD23 ' A' ' 493' ' ' LEU . 1.4 pp -83.59 -43.43 15.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.953 -0.567 . . . . 0.55000000000000004 111.548 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.29 -33.98 44.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.5 -0.318 . . . . 2.5299999999999998 111.314 -179.528 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.458 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -69.52 -39.67 77.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.384 -0.371 . . . . 2.02 111.249 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.592 ' CE2' HG22 ' A' ' 454' ' ' VAL . 15.2 m-85 . . . . . 0 N--CA 1.451 -0.406 0 CA-C-O 121.493 0.663 . . . . 1.25 110.102 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.839 ' CD2' HG11 ' A' ' 492' ' ' VAL . 3.4 mp . . . . . 0 N--CA 1.449 -0.476 0 CA-C-O 120.94 0.4 . . . . 0.97999999999999998 111.226 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.55 157.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.748 -0.66 . . . . 0.66000000000000003 111.688 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.4 -24.35 67.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 1.5700000000000001 110.154 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -90.78 -45.17 8.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.779 -0.646 . . . . 1.53 110.544 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.622 ' O ' HG12 ' A' ' 492' ' ' VAL . 4.2 mt-30 -63.38 -42.78 98.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.58 -0.736 . . . . 1.1399999999999999 110.052 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.432 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 93.4 m -50.19 -28.59 7.76 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.086 0.469 . . . . 0.40999999999999998 109.747 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.608 HG13 HD22 ' A' ' 474' ' ' LEU . 5.1 t -84.73 -41.27 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.562 -0.745 . . . . 0.34999999999999998 109.982 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 491' ' ' ASN . . . . . 0.409 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 3.3 t30 -57.89 -26.13 61.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.265 -0.88 . . . . 0.40999999999999998 110.374 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.839 HG11 ' CD2' ' A' ' 484' ' ' LEU . 3.6 p -101.96 -14.41 8.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.871 -0.604 . . . . 0.31 111.103 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 1.002 HD23 ' HB3' ' A' ' 474' ' ' LEU . 1.4 tp -88.83 -35.98 16.28 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.059 0.456 . . . . 0.98999999999999999 110.585 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.626 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -56.08 -41.97 75.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.556 . . . . 0.28999999999999998 111.305 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.404 ' O ' ' CD ' ' A' ' 498' ' ' LYS . 0.0 OUTLIER -64.21 -38.59 91.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.864 -0.607 . . . . 0.82999999999999996 112.259 -179.212 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.682 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.7 mt -79.84 -30.45 13.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 112.922 0.712 . . . . 0.31 112.922 -178.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.872 ' HB3' HD13 ' B' ' 597' ' ' LEU . 1.1 mm? -49.93 -54.12 21.81 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.048 0.388 . . . . 0.56999999999999995 112.048 -178.743 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.684 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.98 -29.97 68.8 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.504 0.557 . . . . 0.79000000000000004 112.504 -178.336 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.578 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.7 mmm180 -60.48 -22.81 63.93 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.998 0.428 . . . . 2.4100000000000001 110.475 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.946 HD22 HD11 ' A' ' 463' ' ' LEU . 77.0 mt -61.15 -47.56 85.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.779 -0.646 . . . . 0.34000000000000002 111.841 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.616 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.5 t-20 55.89 56.3 9.78 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.028 -0.533 . . . . 0.60999999999999999 110.051 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.616 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 49.2 Cg_endo -99.55 -160.35 0.04 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 123.965 3.11 . . . . 0.26000000000000001 111.518 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.81 140.83 49.31 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 116.042 -0.526 . . . . 1.1699999999999999 109.769 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.57 134.46 36.47 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.384 0.611 . . . . 2.5 111.463 -179.004 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -156.11 160.14 39.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.105 -0.952 . . . . 0.78000000000000003 109.727 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.415 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.7 OUTLIER -105.04 110.09 22.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.875 0.369 . . . . 0.62 111.643 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.535 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.74 110.9 22.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.38 109.872 179.04 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 32.6 t30 59.12 44.15 16.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.323 -0.398 . . . . 1.3999999999999999 110.829 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 72.02 13.08 5.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.121 -0.49 . . . . 1.6599999999999999 111.414 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.429 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.11 132.95 56.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.616 -0.266 . . . . 1.25 110.885 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.684 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.98 108.67 1.56 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.028 0.442 . . . . 1.1299999999999999 110.747 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.535 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 16.1 m80 -122.75 124.92 44.47 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 1.55 111.026 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.575 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.1 OUTLIER -106.08 123.54 48.16 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.765 -0.457 . . . . 1.27 109.765 178.676 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.67 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.2 OUTLIER 179.6 169.33 1.12 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.163 0.506 . . . . 0.54000000000000004 111.936 -178.907 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.582 ' CD2' ' HB2' ' A' ' 463' ' ' LEU . 0.4 OUTLIER -110.83 169.52 8.7 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.541 -0.754 . . . . 1.52 110.249 179.0 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.31 105.39 4.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.172 0.51 . . . . 1.1799999999999999 110.867 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.794 ' HG2' HG22 ' A' ' 464' ' ' THR . 4.5 pt-20 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.244 -0.884 . . . . 3.3300000000000001 110.993 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 587' ' ' ASP . . . . . 0.636 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 120.819 0.342 . . . . 0.0 111.578 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -53.3 -55.02 28.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.021 0.438 . . . . 0.0 111.546 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 589' ' ' HIS . . . . . 0.405 ' HA ' ' HB3' ' B' ' 592' ' ' TYR . 1.5 p80 -79.83 -21.77 43.81 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.254 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.903 HD11 ' HA ' ' A' ' 471' ' ' LYS . 30.0 tp -50.86 -35.43 32.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.184 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 75.3 mt -85.89 -29.42 6.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.898 0.38 . . . . 0.0 110.908 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.535 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.21 -45.23 95.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.294 -179.793 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.794 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.6 -18.53 54.42 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.958 0.409 . . . . 0.0 110.35 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.65 ' N ' HD13 ' B' ' 593' ' ' LEU . 69.1 tt0 -63.19 -30.97 72.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.962 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 6.8 pt-20 -82.43 -42.59 18.36 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 1.002 HD12 ' HE3' ' A' ' 498' ' ' LYS . 1.0 OUTLIER -52.39 -26.79 9.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.224 0.535 . . . . 0.0 111.504 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' A' ' 497' ' ' LEU . 14.3 tp -74.62 -81.07 0.07 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.426 -0.807 . . . . 0.0 112.492 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.678 HG13 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.437 -1.105 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.617 -177.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.532 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.7 t . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 120.918 0.39 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 31.4 p -131.91 173.32 11.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.663 0.744 . . . . 0.0 112.605 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.761 ' HA ' HG23 ' A' ' 496' ' ' ILE . 13.3 mt-10 -69.03 -52.53 27.67 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.574 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -27.82 68.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.175 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 458' ' ' ALA . . . . . . . . . . . . . . . -65.16 -58.07 6.95 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.974 0.416 . . . . 0.0 111.174 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.775 HG11 HD11 ' A' ' 500' ' ' LEU . 21.7 t -52.29 -25.57 7.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.621 -179.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.2 mmm-85 -62.95 -41.8 99.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.927 0.394 . . . . 0.0 110.468 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 461' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -23.92 67.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.597 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.521 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 14.7 m-30 -76.04 -44.05 41.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.775 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.68 HD11 HD22 ' A' ' 500' ' ' LEU . 1.1 mt -65.98 -59.67 3.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.748 0.309 . . . . 0.0 111.328 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.513 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -50.0 -26.21 4.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.039 0.447 . . . . 0.0 110.358 179.647 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -88.8 -42.46 11.89 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.724 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.519 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -172.54 161.62 4.07 Favored Pre-proline 0 CA--C 1.531 0.231 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.326 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.643 ' HB2' ' CD2' ' A' ' 512' ' ' HIS . 69.0 Cg_endo -73.3 173.03 14.43 Favored 'Trans proline' 0 N--CA 1.464 -0.252 0 C-N-CA 121.857 1.705 . . . . 0.0 112.91 -179.301 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.962 ' HG3' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -166.81 159.77 13.98 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-O 121.703 0.763 . . . . 0.0 112.613 -179.557 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.55 ' HB ' ' HZ2' ' A' ' 471' ' ' LYS . 9.2 p -113.51 155.8 24.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.559 -1.201 . . . . 0.0 108.333 177.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.756 ' HA ' HD12 ' A' ' 473' ' ' LEU . 0.6 OUTLIER -50.74 -43.75 58.23 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.53 -178.895 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.903 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -60.86 -56.92 15.49 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.153 0.502 . . . . 0.0 109.973 179.016 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -56.78 -19.87 19.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.963 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 1.016 ' CD1' HD11 ' A' ' 497' ' ' LEU . 5.9 mt -81.69 -37.89 26.68 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -179.225 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.882 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.4 OUTLIER -84.05 -42.53 16.04 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -178.719 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.611 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 26.3 mmtm -47.21 -27.41 1.48 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.686 0.279 . . . . 0.0 111.612 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.478 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -87.33 -40.27 14.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.996 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.532 ' CD2' HG22 ' A' ' 454' ' ' VAL . 15.7 m-85 . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.818 HD21 HG11 ' A' ' 492' ' ' VAL . 9.1 tp . . . . . 0 N--CA 1.452 -0.367 0 CA-C-O 120.962 0.41 . . . . 0.0 111.395 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.94 144.04 3.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.4 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 39.4 t -59.27 -20.03 50.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.786 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -94.61 -43.53 8.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.087 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.616 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.4 mt-30 -68.88 -40.75 79.05 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.184 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.513 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 41.4 m -50.87 -28.79 10.3 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.651 HG12 ' HG ' ' B' ' 593' ' ' LEU . 3.5 t -82.01 -41.96 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.395 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -59.52 -28.16 66.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.302 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.818 HG11 HD21 ' A' ' 484' ' ' LEU . 6.3 p -102.02 -6.95 9.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.019 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.612 HD21 ' CB ' ' A' ' 473' ' ' LEU . 10.2 tp -94.27 -44.77 7.8 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.801 0.334 . . . . 0.0 110.936 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.94 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -51.92 -38.1 55.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.207 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.435 ' HA ' ' NZ ' ' A' ' 498' ' ' LYS . 0.0 OUTLIER -61.32 -40.08 92.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.185 -179.368 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.761 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.5 mt -74.95 -50.14 26.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.046 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 1.016 HD11 ' CD1' ' A' ' 473' ' ' LEU . 0.5 OUTLIER -32.2 -44.15 0.09 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -178.194 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 1.002 ' HE3' HD12 ' B' ' 596' ' ' ILE . 0.1 OUTLIER -70.1 -38.16 75.59 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.576 ' HG3' ' HG2' ' A' ' 456' ' ' GLU . 1.4 mmm180 -58.79 -20.81 53.31 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.963 0.411 . . . . 0.0 110.578 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.775 HD11 HG11 ' A' ' 459' ' ' VAL . 67.4 mt -57.85 -47.58 82.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.86 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.55 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.7 t-20 60.58 58.85 3.92 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.143 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.55 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.0 Cg_endo -101.14 -162.71 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 124.168 3.245 . . . . 0.0 111.943 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.1 138.35 54.23 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.418 178.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.63 131.48 35.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.56 0.695 . . . . 0.0 112.104 -178.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.586 ' HE3' ' CE1' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -156.6 160.43 39.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.307 179.43 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.19 108.88 20.66 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.629 HG12 ' ND1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -89.62 110.81 22.18 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.52 178.185 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 64.28 42.53 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.154 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.3 t0 67.21 20.07 10.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.354 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.405 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.13 130.02 56.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.653 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 7.1 tpt -62.75 106.94 0.87 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.732 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.643 ' CD2' ' HB2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -124.55 156.15 37.84 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.883 -179.251 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.474 ' CZ ' HD23 ' B' ' 597' ' ' LEU . 0.2 OUTLIER -133.21 122.42 23.94 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.674 177.733 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.614 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.1 OUTLIER -177.76 169.33 2.07 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.064 0.459 . . . . 0.0 111.513 -179.456 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.796 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -123.67 168.0 13.24 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.935 178.59 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.444 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -137.87 106.28 5.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.976 179.558 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.513 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.159 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 587' ' ' ASP . . . . . 0.631 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 120.75 0.31 . . . . 0.0 111.579 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -51.7 -55.19 20.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.094 0.473 . . . . 0.0 111.769 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 589' ' ' HIS . . . . . 0.638 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.6 p80 -78.69 -21.94 47.46 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.239 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.904 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.3 tp -58.83 -29.49 66.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.08 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 86.2 mt -85.96 -32.54 6.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.638 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.2 OUTLIER -71.71 -38.37 70.54 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.388 -0.525 . . . . 0.0 112.158 -178.995 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.814 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -70.58 -17.97 62.9 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.112 179.964 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.52 ' N ' HD13 ' B' ' 593' ' ' LEU . 4.2 pt-20 -62.25 -30.68 71.29 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.739 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.416 ' CG ' ' O ' ' B' ' 592' ' ' TYR . 1.5 pt-20 -82.82 -42.96 17.22 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -179.016 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.667 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.0 pp -52.48 -26.48 9.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.228 0.537 . . . . 0.0 110.816 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.879 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.4 tp -72.85 -82.27 0.05 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.249 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.68 HG22 ' HG ' ' B' ' 597' ' ' LEU . 31.2 m . . . . . 0 N--CA 1.438 -1.052 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.757 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.578 HG22 ' CD2' ' A' ' 477' ' ' PHE . 26.6 t . . . . . 0 CA--C 1.518 -0.285 0 CA-C-O 120.918 0.389 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.425 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.2 p -131.65 167.69 19.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.716 0.77 . . . . 0.0 112.479 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.738 ' HA ' HG23 ' A' ' 496' ' ' ILE . 22.1 mt-10 -62.94 -53.08 59.62 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.645 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -27.42 68.82 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.533 -178.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.446 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -66.66 -58.34 5.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.911 0.386 . . . . 0.0 111.238 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.954 HG13 HD11 ' A' ' 473' ' ' LEU . 16.9 t -49.76 -31.68 6.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.187 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.575 ' HD3' HD23 ' A' ' 500' ' ' LEU . 1.0 OUTLIER -55.54 -47.31 76.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.396 178.97 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.46 ' HG2' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -60.73 -26.79 67.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.939 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.691 ' HD2' HD21 ' A' ' 473' ' ' LEU . 4.3 m-30 -73.35 -45.35 55.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.048 0.451 . . . . 0.0 110.314 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.04 HD11 HD13 ' A' ' 500' ' ' LEU . 2.5 mt -67.2 -58.46 4.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.842 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.564 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.2 OUTLIER -52.11 -23.84 6.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.908 0.385 . . . . 0.0 110.924 -179.788 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 -93.44 -44.24 8.35 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.308 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.461 ' HE2' ' HG2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -168.15 134.02 1.59 Allowed Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.005 -179.761 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.495 ' HA ' ' HB2' ' A' ' 514' ' ' SER . 30.6 Cg_endo -60.94 142.11 96.57 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.244 1.963 . . . . 0.0 112.607 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.592 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -128.07 178.74 6.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.329 -179.422 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.695 HG23 ' ND1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -119.34 154.26 33.85 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 177.369 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.529 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -51.24 -44.66 61.75 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.04 -0.664 . . . . 0.0 110.839 -179.34 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.831 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -65.6 -54.8 22.72 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.484 178.514 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 472' ' ' ASP . . . . . 0.426 ' HB3' ' H ' ' A' ' 469' ' ' THR . 24.9 t0 -58.65 -21.16 53.33 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.704 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.954 HD11 HG13 ' A' ' 459' ' ' VAL . 0.4 OUTLIER -80.14 -40.65 26.95 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 121.106 0.479 . . . . 0.0 111.628 -179.606 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.904 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.9 OUTLIER -83.8 -48.53 9.98 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.58 -178.968 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.597 ' HD3' HD12 ' A' ' 474' ' ' LEU . 29.9 mmtp -48.8 -26.72 2.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.693 0.282 . . . . 0.0 111.667 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.442 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -78.84 -36.16 42.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.1 179.869 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.59 ' HB2' HG21 ' A' ' 489' ' ' THR . 11.5 m-85 . . . . . 0 CA--C 1.519 -0.212 0 CA-C-O 121.371 0.605 . . . . 0.0 111.009 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.444 ' CD2' HG11 ' A' ' 492' ' ' VAL . 4.7 mp . . . . . 0 N--CA 1.45 -0.474 0 CA-C-O 121.018 0.437 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.42 154.7 1.7 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.581 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 486' ' ' SER . . . . . 0.504 ' O ' HG23 ' A' ' 490' ' ' VAL . 53.2 p -62.31 -23.54 66.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.019 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -87.44 -51.97 5.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.558 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -62.02 -41.79 98.46 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.353 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.59 HG21 ' HB2' ' A' ' 477' ' ' PHE . 62.0 m -49.13 -39.69 29.53 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.744 HG13 HD22 ' A' ' 474' ' ' LEU . 2.3 t -66.42 -49.96 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.385 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.01 -28.36 9.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.762 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.444 HG11 ' CD2' ' A' ' 484' ' ' LEU . 7.1 p -102.04 -13.8 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.011 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 1.022 HD22 ' CD2' ' A' ' 497' ' ' LEU . 0.4 OUTLIER -89.49 -41.19 12.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 120.751 0.31 . . . . 0.0 110.841 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.549 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -50.52 -41.2 53.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.08 0.467 . . . . 0.0 110.774 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.402 ' OE1' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -65.85 -40.06 91.37 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.375 -179.929 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.738 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.4 mt -75.84 -39.17 37.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.914 -179.537 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 1.022 ' CD2' HD22 ' A' ' 493' ' ' LEU . 2.4 mm? -42.95 -60.34 1.66 Allowed 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -178.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.667 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.79 -28.76 67.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.862 0.363 . . . . 0.0 111.522 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -27.07 66.08 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.172 0.51 . . . . 0.0 110.609 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.04 HD13 HD11 ' A' ' 463' ' ' LEU . 45.0 mt -60.58 -47.41 86.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.744 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.576 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.2 t-20 57.22 58.25 7.8 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.743 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.576 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 78.7 Cg_endo -101.31 -159.63 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.428 0 C-N-CA 124.039 3.159 . . . . 0.0 111.504 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.0 141.8 48.07 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.927 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 504' ' ' ARG . . . . . 0.454 ' HB2' ' HE1' ' A' ' 511' ' ' MET . 4.3 ppt_? -79.58 135.32 36.57 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.293 0.568 . . . . 0.0 111.315 -179.028 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.4 mtmt -155.57 134.65 12.17 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.698 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.512 ' HB2' ' HE2' ' A' ' 506' ' ' MET . 12.4 ptm -82.83 110.43 17.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.013 0.435 . . . . 0.0 111.636 -179.312 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.484 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.68 111.0 22.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.748 178.973 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 58.9 t30 60.4 38.72 19.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.913 0.387 . . . . 0.0 110.464 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 3.5 t0 78.58 11.79 1.62 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.408 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 507' ' ' ILE . 0.0 OUTLIER -116.26 125.48 52.26 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.694 0.283 . . . . 0.0 111.271 179.83 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.552 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -57.47 109.07 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.987 0.422 . . . . 0.0 110.954 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.695 ' ND1' HG23 ' A' ' 469' ' ' THR . 9.2 m80 -120.43 138.72 53.63 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.722 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.711 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -107.49 124.17 49.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.279 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.495 ' HB2' ' HA ' ' A' ' 467' ' ' PRO . 0.6 OUTLIER -170.34 169.36 7.63 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.997 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.608 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.1 pt? -128.9 169.02 15.13 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.893 -1.048 . . . . 0.0 108.997 178.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.409 ' H ' ' HD2' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -129.67 106.54 8.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.017 0.437 . . . . 0.0 111.289 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.564 ' HG2' HG22 ' A' ' 464' ' ' THR . 4.8 pt-20 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.251 -0.88 . . . . 0.0 111.02 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 587' ' ' ASP . . . . . 0.487 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.078 0 CA-C-O 120.823 0.344 . . . . 0.0 111.565 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -50.86 -44.65 59.64 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.921 0.391 . . . . 0.0 111.331 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 2.3 p80 -80.31 -21.93 42.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.577 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.922 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.6 tp -55.86 -31.74 63.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.998 0.428 . . . . 0.0 110.861 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.1 mt -85.91 -29.53 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.998 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.544 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.77 -39.81 91.39 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.634 -179.436 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.858 HD23 ' CB ' ' A' ' 494' ' ' ALA . 0.0 OUTLIER -78.63 -18.58 54.28 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.084 0.468 . . . . 0.0 110.037 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.826 ' N ' HD13 ' B' ' 593' ' ' LEU . 52.3 tt0 -63.53 -34.19 77.25 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.445 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -76.68 -44.7 32.6 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -178.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.987 HD12 ' HE2' ' A' ' 498' ' ' LYS . 2.9 pt -50.66 -26.87 4.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 121.158 0.504 . . . . 0.0 111.789 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.786 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.9 tp -75.36 -80.67 0.08 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.43 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.697 HG13 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.437 -1.116 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.602 -177.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.665 HG22 ' CD2' ' A' ' 477' ' ' PHE . 12.5 t . . . . . 0 CA--C 1.516 -0.332 0 CA-C-O 120.971 0.415 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.551 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.8 p -131.78 165.97 22.59 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.607 0.717 . . . . 0.0 112.485 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.756 ' HA ' HG23 ' A' ' 496' ' ' ILE . 16.9 mt-10 -61.24 -53.74 53.01 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.54 179.098 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.49 -28.07 65.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.206 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.425 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -74.1 -38.26 63.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.701 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.807 ' HB ' HD21 ' A' ' 500' ' ' LEU . 15.7 t -70.59 -37.92 71.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.206 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 2.0 mmm-85 -52.54 -54.82 27.61 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.481 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -56.45 -27.46 56.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.85 179.497 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.487 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 17.5 m-30 -73.52 -46.96 44.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.13 179.091 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.015 HD11 HD13 ' A' ' 500' ' ' LEU . 2.1 mt -65.79 -57.44 7.97 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.407 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.714 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.2 OUTLIER -48.27 -27.54 2.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.11 0.481 . . . . 0.0 110.421 179.933 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.493 ' O ' ' HG2' ' A' ' 466' ' ' LYS . 10.8 ttt85 -88.58 -54.08 4.34 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.648 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.538 ' HD3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -158.81 152.13 18.84 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.974 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.567 ' HB2' ' HB3' ' A' ' 512' ' ' HIS . 80.9 Cg_endo -72.97 175.86 9.85 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.619 2.213 . . . . 0.0 112.94 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.697 ' HG3' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -168.46 166.25 12.28 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.204 0.526 . . . . 0.0 112.044 -178.719 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.614 HG22 ' CD2' ' A' ' 512' ' ' HIS . 4.1 p -105.36 154.97 19.57 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 177.079 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.76 ' HA ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -55.64 -33.71 64.29 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.141 -179.564 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.878 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.1 OUTLIER -69.38 -52.03 31.02 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.309 0.576 . . . . 0.0 109.463 178.9 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -58.82 -31.13 68.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.378 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.939 ' CD1' HD11 ' A' ' 497' ' ' LEU . 3.2 mt -64.7 -48.58 74.15 Favored 'General case' 0 CA--C 1.522 -0.099 0 CA-C-O 120.939 0.399 . . . . 0.0 111.271 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.922 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.8 OUTLIER -79.67 -32.09 41.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.956 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.401 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -58.73 -26.83 64.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.175 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -86.28 -43.05 13.24 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.587 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.665 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.8 m-85 . . . . . 0 N--CA 1.451 -0.42 0 CA-C-O 121.488 0.661 . . . . 0.0 110.192 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.565 ' CD2' HG11 ' A' ' 492' ' ' VAL . 3.3 mp . . . . . 0 N--CA 1.45 -0.435 0 CA-C-O 120.914 0.388 . . . . 0.0 111.277 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -41.37 152.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.913 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 486' ' ' SER . . . . . 0.544 ' O ' HG23 ' A' ' 490' ' ' VAL . 2.2 p -61.56 -24.72 66.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.07 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -84.36 -53.51 5.41 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.531 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -59.93 -43.46 94.92 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.034 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 54.9 m -47.78 -32.26 5.79 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-O 121.194 0.521 . . . . 0.0 109.704 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.868 HG22 HD22 ' A' ' 474' ' ' LEU . 3.9 t -75.62 -45.47 38.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.04 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -56.51 -27.36 57.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.118 179.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.565 HG11 ' CD2' ' A' ' 484' ' ' LEU . 8.3 p -102.11 -12.77 8.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.087 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.621 HD23 ' HB3' ' A' ' 474' ' ' LEU . 10.2 tp -89.39 -41.3 12.19 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.786 0.327 . . . . 0.0 110.913 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.923 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -53.99 -41.04 67.48 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.013 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.7 OUTLIER -57.17 -41.37 79.13 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.432 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.756 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.8 mt -79.84 -31.2 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -177.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.939 HD11 ' CD1' ' A' ' 473' ' ' LEU . 1.7 mm? -51.07 -50.29 58.98 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -178.094 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.987 ' HE2' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -69.44 -24.26 63.79 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -177.875 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.551 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 10.5 mmm-85 -61.94 -19.58 62.88 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.226 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.015 HD13 HD11 ' A' ' 463' ' ' LEU . 23.1 mt -66.08 -47.68 73.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.26 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.551 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.5 t-20 56.96 59.37 7.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.547 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.551 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 84.4 Cg_endo -101.02 -157.96 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.375 0 C-N-CA 123.918 3.079 . . . . 0.0 111.465 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.08 139.66 53.02 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.082 179.182 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.62 135.75 36.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.258 0.551 . . . . 0.0 111.478 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -154.72 160.08 41.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.733 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -104.97 108.9 20.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.902 0.382 . . . . 0.0 111.691 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.542 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.92 110.82 22.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.067 178.951 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 58.88 44.22 16.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.056 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.1 t70 74.32 8.1 4.57 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.47 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.45 ' O ' ' N ' ' A' ' 507' ' ' ILE . 1.5 tpmt? -113.48 130.79 56.25 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-O 120.651 0.262 . . . . 0.0 110.754 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 5.4 tpt -67.54 108.69 2.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.051 0.453 . . . . 0.0 110.994 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.614 ' CD2' HG22 ' A' ' 469' ' ' THR . 12.0 m170 -122.45 138.17 54.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.632 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.693 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -105.15 133.2 50.31 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.96 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.462 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -176.87 169.24 2.46 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.918 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.592 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.3 pt? -129.76 168.9 15.84 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.196 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.406 ' H ' ' HD2' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -133.12 106.48 7.64 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.01 0.434 . . . . 0.0 111.438 179.78 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.714 ' HB2' HG22 ' A' ' 464' ' ' THR . 4.5 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.827 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 587' ' ' ASP . . . . . 0.587 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.741 0.305 . . . . 0.0 111.752 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 -50.48 -45.77 56.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.93 0.395 . . . . 0.0 111.354 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 589' ' ' HIS . . . . . 0.719 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 2.3 p80 -80.29 -21.88 42.18 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.351 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.943 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.7 tp -64.99 -28.99 69.89 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.324 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 77.9 mt -85.51 -32.71 7.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.719 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.58 -39.29 70.66 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.464 -0.495 . . . . 0.0 111.837 -179.243 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.815 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -70.72 -17.9 62.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.202 0.525 . . . . 0.0 110.081 -179.822 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.774 ' N ' HD13 ' B' ' 593' ' ' LEU . 3.8 pt-20 -63.21 -30.8 71.87 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.012 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -83.01 -43.0 16.86 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.696 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.9 pp -52.22 -26.59 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.196 0.522 . . . . 0.0 110.935 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.877 HD22 ' HG ' ' A' ' 497' ' ' LEU . 11.8 tp -69.56 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.336 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.694 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.44 -0.974 0 CA-C-N 114.693 -1.139 . . . . 0.0 110.575 -178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.621 HG22 ' CE2' ' A' ' 477' ' ' PHE . 19.3 t . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 121.008 0.432 . . . . 0.0 110.674 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 26.3 p -131.55 173.39 11.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.644 0.735 . . . . 0.0 112.66 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.669 ' HA ' HG23 ' A' ' 496' ' ' ILE . 15.1 mt-10 -68.04 -53.07 28.5 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.385 179.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.83 -28.8 62.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.192 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -70.04 -58.24 4.05 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.748 0.309 . . . . 0.0 111.347 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.806 HG13 HD11 ' A' ' 473' ' ' LEU . 19.2 t -51.75 -26.31 6.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.759 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.591 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.3 mmm-85 -63.09 -44.42 95.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.804 0.335 . . . . 0.0 110.336 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.452 ' HG2' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -61.74 -24.98 67.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.504 179.684 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.507 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 4.0 m-30 -71.61 -46.37 59.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.998 0.428 . . . . 0.0 110.153 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.071 HD11 HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -65.91 -58.29 5.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.479 -179.92 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.742 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -50.46 -23.92 2.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.932 0.396 . . . . 0.0 110.599 179.788 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.5 mtt85 -94.11 -42.67 8.87 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.417 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.466 ' HD2' ' O ' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -173.36 156.28 2.85 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 120.766 0.317 . . . . 0.0 111.27 -179.737 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.615 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 71.8 Cg_endo -73.62 147.3 40.21 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.743 2.295 . . . . 0.0 113.463 -179.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.762 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -143.35 149.58 37.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.846 -179.702 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.626 HG22 ' O ' ' A' ' 511' ' ' MET . 12.1 p -90.14 177.37 6.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 176.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.87 HG22 ' CD2' ' A' ' 497' ' ' LEU . 0.5 OUTLIER -70.97 -34.96 71.92 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.147 -0.621 . . . . 0.0 111.06 -179.735 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.873 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -72.48 -49.5 32.69 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.661 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -60.77 -34.49 74.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.691 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.808 HD22 HD11 ' A' ' 493' ' ' LEU . 0.9 OUTLIER -64.19 -42.22 96.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.973 0.416 . . . . 0.0 110.9 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 1.026 HD22 HG22 ' A' ' 490' ' ' VAL . 3.0 pp -84.13 -33.06 24.37 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.741 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.636 ' N ' HD12 ' A' ' 474' ' ' LEU . 0.1 OUTLIER -49.06 -26.83 2.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.617 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -86.09 -43.63 12.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.492 -179.825 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.621 ' CE2' HG22 ' A' ' 454' ' ' VAL . 5.4 m-85 . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 121.112 0.482 . . . . 0.0 111.406 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.999 HD23 HG11 ' A' ' 492' ' ' VAL . 1.1 mp . . . . . 0 N--CA 1.449 -0.519 0 CA-C-O 121.016 0.436 . . . . 0.0 111.028 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.78 155.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.709 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.5 m -60.63 -22.64 64.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.129 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -91.23 -44.93 8.92 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.61 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.752 ' O ' HG12 ' A' ' 492' ' ' VAL . 2.2 mt-30 -65.41 -40.62 93.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.115 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 70.2 m -51.02 -28.57 10.4 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.21 0.529 . . . . 0.0 109.595 178.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 1.026 HG22 HD22 ' A' ' 474' ' ' LEU . 14.4 t -84.97 -41.64 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.831 178.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 491' ' ' ASN . . . . . 0.463 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 7.1 t30 -60.96 -29.22 69.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.025 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.999 HG11 HD23 ' A' ' 484' ' ' LEU . 7.3 p -98.6 -7.25 9.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.924 179.477 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.808 HD11 HD22 ' A' ' 473' ' ' LEU . 39.2 tp -94.61 -46.89 6.76 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 121.029 0.442 . . . . 0.0 110.714 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.671 ' CB ' HD23 ' B' ' 593' ' ' LEU . . . -49.74 -34.12 18.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.401 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.7 OUTLIER -68.35 -44.07 76.09 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.72 -179.493 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.669 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.5 mt -79.39 -32.64 14.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.877 ' HG ' HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -44.12 -56.99 3.65 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.589 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.696 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.9 -33.36 71.75 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -178.097 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.575 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 14.3 mmm180 -56.64 -22.18 32.44 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.981 0.42 . . . . 0.0 110.814 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.071 HD22 HD11 ' A' ' 463' ' ' LEU . 93.6 mt -59.64 -47.6 84.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.171 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.595 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.0 t-20 58.36 57.48 6.41 Favored Pre-proline 0 C--N 1.32 -0.716 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.311 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.595 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 56.5 Cg_endo -99.84 -159.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 124.137 3.225 . . . . 0.0 111.363 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.8 139.78 52.65 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.771 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 5.3 ptt-85 -79.64 133.44 36.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.488 0.661 . . . . 0.0 111.5 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -156.25 160.21 39.58 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.664 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.403 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -103.86 110.39 22.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.995 0.426 . . . . 0.0 111.502 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.483 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.64 110.86 22.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.942 179.085 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.3 t30 59.8 43.13 15.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.841 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 73.28 12.36 4.85 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.35 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.413 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -116.1 131.38 56.96 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.866 179.826 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.626 ' O ' HG22 ' A' ' 469' ' ' THR . 28.9 mmm -62.9 108.49 1.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.061 0.457 . . . . 0.0 110.552 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.493 ' CE1' HG23 ' A' ' 469' ' ' THR . 23.7 m80 -122.76 125.52 45.65 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.081 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.626 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -104.92 123.37 47.63 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 178.71 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.615 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER 179.43 169.37 1.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.08 0.467 . . . . 0.0 111.33 -178.952 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.791 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -118.78 168.7 10.5 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.641 178.547 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.43 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -136.9 106.05 6.0 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.082 0.467 . . . . 0.0 111.219 179.54 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.742 ' HG2' HG22 ' A' ' 464' ' ' THR . 3.2 pt-20 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.087 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 587' ' ' ASP . . . . . 0.408 ' HA ' ' HB3' ' B' ' 590' ' ' LEU . 1.3 p-10 . . . . . 0 N--CA 1.451 -0.415 0 CA-C-O 120.823 0.344 . . . . 0.0 111.541 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -56.15 -55.25 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.083 0.468 . . . . 0.0 111.699 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 589' ' ' HIS . . . . . 0.692 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.9 p80 -76.57 -21.97 54.93 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.319 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.925 ' CD1' HD21 ' A' ' 474' ' ' LEU . 19.5 tp -61.06 -29.32 69.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.452 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 82.6 mt -85.92 -34.4 8.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.692 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.4 OUTLIER -71.53 -40.74 69.87 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 120.51 -0.476 . . . . 0.0 112.163 -178.812 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.836 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.4 -18.62 65.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.211 0.529 . . . . 0.0 110.052 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.536 ' N ' HD13 ' B' ' 593' ' ' LEU . 14.3 tt0 -63.62 -30.41 71.52 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.551 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.52 -48.05 18.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.241 -178.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.856 HD11 ' HB1' ' A' ' 494' ' ' ALA . 1.6 pp -51.16 -26.68 5.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.103 0.478 . . . . 0.0 110.94 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.997 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.2 tp -62.48 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.541 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.696 HG22 ' HG ' ' B' ' 597' ' ' LEU . 34.9 m . . . . . 0 N--CA 1.438 -1.06 0 CA-C-N 114.877 -1.056 . . . . 0.0 111.245 -177.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.617 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.1 t . . . . . 0 CA--C 1.518 -0.264 0 CA-C-O 120.996 0.427 . . . . 0.0 110.802 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.521 ' O ' HG23 ' A' ' 459' ' ' VAL . 28.2 p -131.65 167.97 18.54 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.585 0.707 . . . . 0.0 112.533 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.59 ' HA ' HG23 ' A' ' 496' ' ' ILE . 17.7 mt-10 -65.1 -54.87 23.33 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.188 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -50.59 -28.39 8.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.654 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.412 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -76.92 -35.83 57.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.762 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.875 HG12 HD21 ' A' ' 500' ' ' LEU . 13.2 t -76.1 -31.89 22.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.709 0.29 . . . . 0.0 111.446 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.539 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.1 mmm180 -61.43 -41.24 96.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.211 179.527 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.454 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -65.81 -29.01 69.42 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.407 179.275 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.454 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 11.4 m-30 -64.3 -45.74 86.66 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.051 HD11 HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -64.56 -59.05 4.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.876 179.534 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.639 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.82 -26.6 1.7 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.234 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -88.89 -49.32 6.87 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.809 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.446 ' HD3' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -171.78 162.81 4.72 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.114 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.504 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 97.4 Cg_endo -80.37 160.08 22.82 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.763 2.309 . . . . 0.0 113.292 -179.156 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.631 ' HE3' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -157.21 168.2 28.11 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.369 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.589 HG22 ' CD2' ' A' ' 512' ' ' HIS . 4.6 p -100.75 176.1 5.42 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 176.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.429 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -71.33 -30.85 66.69 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 119.992 -0.683 . . . . 0.0 111.401 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.856 ' HB3' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -77.17 -50.17 13.56 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.569 0.699 . . . . 0.0 109.388 178.53 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -57.91 -31.4 66.73 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.12 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.644 HD11 HG13 ' A' ' 459' ' ' VAL . 0.9 OUTLIER -70.49 -39.22 74.31 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-O 120.989 0.423 . . . . 0.0 110.664 179.852 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.925 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.1 pp -84.2 -33.15 24.22 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.938 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.581 ' N ' HD12 ' A' ' 474' ' ' LEU . 0.0 OUTLIER -47.42 -27.67 1.79 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.372 -179.058 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.452 ' HE3' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -85.35 -43.08 13.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.171 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.617 ' CE2' HG22 ' A' ' 454' ' ' VAL . 10.0 m-85 . . . . . 0 N--CA 1.455 -0.214 0 CA-C-O 121.109 0.48 . . . . 0.0 111.26 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.828 ' CD2' HG11 ' A' ' 492' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 120.937 0.398 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -43.9 149.93 0.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.669 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.76 -21.65 61.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.467 179.125 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -91.59 -49.17 6.44 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.716 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.628 ' O ' HG12 ' A' ' 492' ' ' VAL . 6.7 mt-30 -62.57 -42.09 99.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.31 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 87.1 m -49.11 -29.6 5.47 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.246 0.546 . . . . 0.0 109.692 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.883 HG22 HD22 ' A' ' 474' ' ' LEU . 13.7 t -83.12 -41.99 17.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.061 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -59.81 -31.97 70.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.063 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.828 HG11 ' CD2' ' A' ' 484' ' ' LEU . 7.6 p -94.86 -11.62 8.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.825 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.642 HD11 HD22 ' A' ' 497' ' ' LEU . 11.5 tp -90.22 -44.89 9.44 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.926 0.393 . . . . 0.0 110.777 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.856 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -50.76 -33.9 25.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.569 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -40.56 83.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.789 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.59 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.7 mt -77.99 -43.42 28.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.997 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.2 OUTLIER -37.77 -56.24 1.1 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -178.466 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.698 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.78 -23.56 63.38 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.557 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.488 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 0.1 OUTLIER -64.74 -18.53 65.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.137 0.494 . . . . 0.0 110.204 179.114 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.051 HD22 HD11 ' A' ' 463' ' ' LEU . 29.9 mt -59.7 -47.59 85.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.104 -179.164 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.644 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.8 t-20 56.63 54.99 8.24 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.287 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.644 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.2 Cg_endo -101.41 -160.27 0.04 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 124.249 3.3 . . . . 0.0 111.67 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.75 141.29 48.76 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.658 178.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.64 133.55 36.4 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.4 0.619 . . . . 0.0 111.512 -178.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -156.29 160.18 39.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.007 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.12 109.78 21.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.866 0.365 . . . . 0.0 111.347 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.498 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -90.73 110.86 22.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.021 179.071 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 58.6 t30 58.88 44.91 15.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.804 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.2 t70 71.57 13.24 6.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.201 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.401 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.09 127.59 54.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.636 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.16 108.51 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.921 0.391 . . . . 0.0 110.438 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.589 ' CD2' HG22 ' A' ' 469' ' ' THR . 9.0 m-70 -122.47 128.22 50.58 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.946 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.636 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -104.89 122.88 46.71 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.733 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.504 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER 179.25 169.33 1.01 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.069 0.461 . . . . 0.0 111.437 -178.757 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.79 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -120.34 168.88 10.83 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.521 178.331 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.01 106.15 7.09 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.136 0.494 . . . . 0.0 111.204 179.605 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.639 ' HG2' HG22 ' A' ' 464' ' ' THR . 2.7 pt-20 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.057 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.779 0.323 . . . . 0.0 111.597 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -50.93 -55.21 18.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.953 0.406 . . . . 0.0 111.719 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 589' ' ' HIS . . . . . 0.659 ' O ' HD12 ' B' ' 593' ' ' LEU . 1.5 p80 -80.11 -21.9 42.75 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.164 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.9 ' CD1' HD21 ' A' ' 474' ' ' LEU . 39.7 tp -54.43 -47.6 72.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.004 0.43 . . . . 0.0 110.859 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 48.9 mt -86.24 -29.6 6.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.785 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.584 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.06 -45.46 77.29 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.387 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 1.111 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -67.96 -20.34 65.05 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.172 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.623 ' N ' HD13 ' B' ' 593' ' ' LEU . 5.8 tt0 -63.44 -30.86 71.92 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.323 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' B' ' 592' ' ' TYR . 0.3 OUTLIER -70.83 -45.83 63.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.532 -179.537 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 1.059 HD11 ' HB1' ' A' ' 494' ' ' ALA . 5.1 pt -58.14 -26.62 29.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.307 0.575 . . . . 0.0 110.678 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.874 HD13 ' HB3' ' A' ' 497' ' ' LEU . 12.2 tp -72.31 -81.74 0.05 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.1 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.754 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.7 m . . . . . 0 N--CA 1.438 -1.059 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.593 -177.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.764 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.2 t . . . . . 0 CA--C 1.519 -0.227 0 CA-C-O 120.83 0.348 . . . . 0.0 110.382 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 459' ' ' VAL . 35.0 p -131.49 170.71 14.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.689 0.757 . . . . 0.0 112.779 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.733 ' HA ' HG23 ' A' ' 496' ' ' ILE . 23.8 mt-10 -69.06 -52.97 22.98 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.328 -1.305 . . . . 0.0 110.73 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.92 -27.5 68.86 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.314 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.466 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -69.71 -36.71 76.15 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.458 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.879 ' HB ' HD21 ' A' ' 500' ' ' LEU . 15.6 t -70.67 -36.92 67.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.808 0.337 . . . . 0.0 110.911 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.583 ' HD3' HD23 ' A' ' 500' ' ' LEU . 1.5 mmm-85 -52.76 -49.56 65.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.953 178.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.532 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -61.66 -23.74 66.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.014 179.8 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.54 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 8.4 m-30 -75.17 -42.62 55.57 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.223 0.535 . . . . 0.0 109.605 178.488 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.04 HD11 HD13 ' A' ' 500' ' ' LEU . 1.8 mt -69.46 -57.66 4.97 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.454 -179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.672 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.1 OUTLIER -48.28 -27.58 2.58 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.091 0.472 . . . . 0.0 110.364 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.656 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 15.2 mtt180 -83.96 -55.75 4.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.517 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.656 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER -163.72 146.37 7.78 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.657 -179.936 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.577 ' HG2' HG13 ' A' ' 507' ' ' ILE . 43.9 Cg_endo -68.1 161.52 44.05 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.64 2.227 . . . . 0.0 113.139 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.595 ' CE ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -159.64 166.61 30.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.567 -179.227 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.883 HG22 ' O ' ' A' ' 511' ' ' MET . 51.8 p -98.73 178.56 4.94 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 470' ' ' THR . . . . . 1.111 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -71.19 -40.74 71.02 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.612 179.703 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.783 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -64.47 -52.2 59.19 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.264 0.554 . . . . 0.0 109.852 179.013 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 472' ' ' ASP . . . . . 0.41 ' H ' ' HG2' ' A' ' 471' ' ' LYS . 46.3 t0 -59.94 -25.04 64.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.621 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.86 HD11 HG13 ' A' ' 459' ' ' VAL . 1.4 tt -86.13 -45.47 11.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.004 0.431 . . . . 0.0 111.616 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.9 HD21 ' CD1' ' B' ' 590' ' ' LEU . 3.6 pp -76.09 -44.1 40.36 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.087 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.557 ' N ' HD12 ' A' ' 474' ' ' LEU . 0.1 OUTLIER -52.34 -24.27 7.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.681 0.277 . . . . 0.0 111.204 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.592 ' HG2' ' N ' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -76.99 -44.43 31.09 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.521 -179.424 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.764 ' CE2' HG22 ' A' ' 454' ' ' VAL . 9.1 m-85 . . . . . 0 CA--C 1.513 -0.466 0 CA-C-O 121.593 0.711 . . . . 0.0 109.753 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.808 ' CD2' HG11 ' A' ' 492' ' ' VAL . 5.0 mp . . . . . 0 N--CA 1.448 -0.552 0 CA-C-O 120.963 0.411 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.66 158.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.704 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 14.7 m -60.84 -27.2 67.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.127 0.489 . . . . 0.0 110.089 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -86.95 -46.63 9.69 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.415 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.474 ' O ' HG12 ' A' ' 492' ' ' VAL . 4.2 mt-30 -63.2 -40.34 97.21 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.0 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 96.7 m -50.71 -28.07 8.32 Favored 'General case' 0 C--N 1.335 -0.058 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.639 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.746 HG13 HD22 ' A' ' 474' ' ' LEU . 4.6 t -82.05 -44.16 19.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.107 179.12 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -56.31 -25.85 50.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.754 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.808 HG11 ' CD2' ' A' ' 484' ' ' LEU . 6.9 p -100.31 -14.17 7.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.546 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.633 HD23 ' CB ' ' A' ' 474' ' ' LEU . 0.2 OUTLIER -91.0 -35.22 14.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.888 0.375 . . . . 0.0 110.91 -179.776 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 1.059 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -58.33 -38.54 77.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.273 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.6 OUTLIER -63.13 -40.83 98.72 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.424 -179.614 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.733 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.3 mt -79.02 -44.31 24.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.569 -178.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.874 ' HB3' HD13 ' B' ' 597' ' ' LEU . 2.3 mm? -41.15 -50.91 3.5 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.521 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.888 ' NZ ' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -64.26 -33.17 75.21 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.873 0.368 . . . . 0.0 111.948 -178.768 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.469 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 0.7 OUTLIER -55.9 -23.3 30.53 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.003 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.04 HD13 HD11 ' A' ' 463' ' ' LEU . 56.8 mt -59.99 -47.54 85.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.924 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.547 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 24.9 t-20 58.13 59.94 6.18 Favored Pre-proline 0 C--N 1.32 -0.715 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.503 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.547 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 84.7 Cg_endo -101.06 -157.29 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.306 0 C-N-CA 123.966 3.111 . . . . 0.0 111.419 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.01 140.44 51.91 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.012 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.8 135.14 36.41 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.337 0.589 . . . . 0.0 111.579 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 14.7 mtmt -156.11 159.26 38.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.587 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.415 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -105.17 111.65 24.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.031 0.443 . . . . 0.0 111.722 -179.64 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.577 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.89 110.94 22.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.001 179.0 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 9.4 t30 58.62 42.96 19.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.836 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 74.45 12.38 3.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.391 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 507' ' ' ILE . 0.0 OUTLIER -116.17 130.96 57.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.854 179.824 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.883 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.97 109.1 1.68 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.962 0.41 . . . . 0.0 111.022 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.563 ' CD2' HG23 ' A' ' 469' ' ' THR . 11.1 m170 -122.31 138.21 54.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.886 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.707 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.1 OUTLIER -111.13 128.33 55.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.114 179.408 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.539 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -179.89 169.24 1.28 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.239 0.542 . . . . 0.0 112.16 -179.097 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.684 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.2 pt? -122.03 169.19 11.08 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.206 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.6 106.62 8.3 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.418 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.672 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.107 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 587' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' B' ' 590' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.379 0 CA-C-O 120.871 0.367 . . . . 0.0 111.617 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -52.06 -55.26 21.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.744 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 589' ' ' HIS . . . . . 0.711 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.7 p80 -77.63 -21.86 51.61 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.251 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.953 ' CD1' HD21 ' A' ' 474' ' ' LEU . 23.4 tp -61.93 -29.46 70.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.344 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 76.0 mt -85.97 -34.64 8.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.711 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.67 -43.54 65.84 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 120.346 -0.542 . . . . 0.0 112.065 -179.018 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 1.121 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -64.08 -18.85 64.79 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.166 -179.656 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.625 ' N ' HD13 ' B' ' 593' ' ' LEU . 3.7 pt-20 -63.55 -30.74 71.81 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.8 -48.48 25.14 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.97 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.621 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.1 pp -53.72 -26.52 13.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.275 0.559 . . . . 0.0 110.721 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.942 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.1 tp -71.85 -82.44 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.969 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.718 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.4 m . . . . . 0 N--CA 1.438 -1.041 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.76 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.624 HG22 ' CE2' ' A' ' 477' ' ' PHE . 3.9 t . . . . . 0 CA--C 1.518 -0.287 0 CA-C-O 120.879 0.371 . . . . 0.0 110.693 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 459' ' ' VAL . 32.5 p -131.77 168.14 18.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.68 0.752 . . . . 0.0 112.578 -179.193 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.757 ' HA ' HG23 ' A' ' 496' ' ' ILE . 20.9 mt-10 -61.59 -53.33 57.65 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.359 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.41 ' HA ' ' HG2' ' A' ' 460' ' ' ARG . 0.2 OUTLIER -64.12 -27.86 69.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.237 -179.257 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.438 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -68.54 -35.81 77.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.363 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.899 ' HB ' HD21 ' A' ' 500' ' ' LEU . 19.0 t -73.52 -35.38 44.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.903 0.383 . . . . 0.0 110.865 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.62 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -52.98 -51.36 61.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.816 178.809 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.513 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -56.15 -30.33 62.02 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.794 179.693 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.704 ' HH ' ' HZ ' ' A' ' 477' ' ' PHE . 11.0 m-30 -71.25 -41.71 69.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.081 0.467 . . . . 0.0 110.205 179.205 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.019 HD11 HD13 ' A' ' 500' ' ' LEU . 1.9 mt -70.8 -58.96 3.09 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.446 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.704 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.56 -27.75 2.97 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.048 0.451 . . . . 0.0 110.756 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -85.91 -52.14 5.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.887 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -166.48 130.49 1.62 Allowed Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.904 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.512 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 12.2 Cg_endo -55.0 160.76 7.42 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.62 2.213 . . . . 0.0 112.708 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.713 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -154.23 178.0 10.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.457 0.646 . . . . 0.0 111.718 -179.156 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.729 HG22 ' CD2' ' A' ' 512' ' ' HIS . 1.3 p -111.24 159.54 17.81 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 470' ' ' THR . . . . . 1.121 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -53.9 -48.09 70.49 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.539 -179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.794 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -56.98 -53.45 57.88 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.251 179.555 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -62.65 -33.47 75.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.727 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.797 HD11 HG13 ' A' ' 459' ' ' VAL . 1.3 tt -70.53 -41.65 72.29 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 121.093 0.473 . . . . 0.0 111.418 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.953 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.4 pp -84.19 -37.3 22.03 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.241 -179.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.07 -40.45 61.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.749 0.309 . . . . 0.0 111.219 -179.435 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.447 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -61.97 -41.68 98.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.138 -179.842 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.704 ' HZ ' ' HH ' ' A' ' 462' ' ' TYR . 13.3 m-85 . . . . . 0 N--CA 1.45 -0.449 0 CA-C-O 121.507 0.67 . . . . 0.0 110.464 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.701 HD13 HG11 ' A' ' 492' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.449 -0.482 0 CA-C-O 120.997 0.427 . . . . 0.0 111.337 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.92 158.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.582 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 486' ' ' SER . . . . . 0.494 ' O ' HG23 ' A' ' 490' ' ' VAL . 12.2 p -62.0 -25.03 67.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.971 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -89.0 -51.15 5.75 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.354 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.514 ' HB3' HD23 ' A' ' 484' ' ' LEU . 0.1 OUTLIER -60.2 -42.93 96.13 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.237 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 47.9 m -49.55 -37.69 28.14 Favored 'General case' 0 CA--C 1.522 -0.12 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 179.082 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.577 HG12 ' HG ' ' B' ' 593' ' ' LEU . 2.7 t -71.19 -46.75 64.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.065 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.79 -25.83 43.15 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.567 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.701 HG11 HD13 ' A' ' 484' ' ' LEU . 9.1 p -101.75 -14.48 8.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.541 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.922 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.1 OUTLIER -91.41 -35.74 14.2 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.968 0.414 . . . . 0.0 110.543 179.928 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.611 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -56.44 -37.01 69.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.092 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.38 -41.49 80.5 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.768 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.757 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.2 mt -77.35 -39.37 27.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.094 -179.286 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.942 ' HB3' HD13 ' B' ' 597' ' ' LEU . 1.4 mm? -42.73 -59.26 2.0 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.65 ' HA ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -60.04 -30.89 69.49 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -178.798 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.405 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 0.4 OUTLIER -56.52 -23.76 41.88 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.019 HD13 HD11 ' A' ' 463' ' ' LEU . 55.9 mt -61.43 -47.49 85.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.756 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.567 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 58.78 59.41 5.6 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.598 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.567 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 77.3 Cg_endo -101.22 -159.32 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.356 0 C-N-CA 123.996 3.131 . . . . 0.0 111.555 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.77 139.87 52.5 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.724 178.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -79.64 133.94 36.42 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.411 0.624 . . . . 0.0 111.592 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 19.2 mtmt -156.3 159.86 39.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.569 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.409 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 0.1 OUTLIER -105.17 111.83 24.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.965 0.412 . . . . 0.0 111.656 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.494 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -90.79 110.92 22.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.976 178.995 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 58.73 42.87 19.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.818 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 509' ' ' ASP . . . . . 0.409 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 0.4 OUTLIER 74.58 12.76 3.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.353 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' A' ' 507' ' ' ILE . 0.0 OUTLIER -116.22 129.25 56.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.681 0.276 . . . . 0.0 110.94 179.851 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 2.9 tpt -62.13 108.57 1.09 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.013 0.435 . . . . 0.0 110.643 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.729 ' CD2' HG22 ' A' ' 469' ' ' THR . 10.8 m170 -122.64 126.98 48.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.137 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.72 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.08 123.75 48.5 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.902 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.707 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.4 OUTLIER -178.94 169.51 1.57 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.158 0.504 . . . . 0.0 112.062 -178.598 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.755 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.4 pt? -116.07 169.15 9.48 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.332 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.403 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -136.48 106.67 6.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.996 0.427 . . . . 0.0 111.429 179.706 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.704 ' HG2' HG22 ' A' ' 464' ' ' THR . 4.9 pt-20 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.151 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p30 . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.722 0.296 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -52.9 -45.7 67.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.017 0.437 . . . . 0.0 111.25 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 3.9 p80 -80.03 -23.43 41.44 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.077 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.941 HD12 HD21 ' A' ' 474' ' ' LEU . 27.3 tp -68.05 -38.85 82.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.801 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.4 mt -85.88 -29.64 6.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.612 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.76 -43.23 80.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.786 -179.455 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.795 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -71.35 -18.16 62.39 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.081 0.467 . . . . 0.0 110.196 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.764 ' N ' HD13 ' B' ' 593' ' ' LEU . 2.4 pt-20 -63.03 -31.67 72.86 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.469 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' B' ' 592' ' ' TYR . 1.0 OUTLIER -76.95 -49.35 15.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.776 -179.364 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.629 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -54.8 -26.54 17.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.155 0.502 . . . . 0.0 110.83 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.95 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.8 tp -69.0 -83.36 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.92 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.66 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.2 m . . . . . 0 N--CA 1.438 -1.027 0 CA-C-N 114.656 -1.157 . . . . 0.0 110.707 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.659 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.0 t . . . . . 0 CA--C 1.517 -0.296 0 CA-C-O 121.019 0.437 . . . . 0.0 110.905 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.549 ' O ' HG23 ' A' ' 459' ' ' VAL . 27.5 p -131.79 172.18 12.61 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.586 0.707 . . . . 0.0 112.575 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.621 ' HA ' HG23 ' A' ' 496' ' ' ILE . 17.0 mt-10 -69.04 -54.82 13.07 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.475 -1.239 . . . . 0.0 110.05 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.04 -27.07 7.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.46 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -75.91 -37.92 58.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.752 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.74 HG13 HD11 ' A' ' 473' ' ' LEU . 6.6 t -74.57 -40.81 48.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.863 0.364 . . . . 0.0 111.428 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.717 ' CD ' HD23 ' A' ' 500' ' ' LEU . 2.4 mmm-85 -54.43 -39.53 67.46 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.232 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -71.01 -26.66 63.22 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.761 179.48 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.516 ' HH ' ' HZ ' ' A' ' 477' ' ' PHE . 15.6 m-30 -67.59 -36.96 81.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.132 0.491 . . . . 0.0 109.918 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.028 HD11 HD22 ' A' ' 500' ' ' LEU . 0.6 OUTLIER -74.84 -58.53 3.23 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.082 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.679 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.42 -28.26 2.04 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-O 121.15 0.5 . . . . 0.0 110.398 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 37.7 mtt85 -85.36 -48.58 8.9 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.561 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.48 130.21 0.54 Allowed Pre-proline 0 CA--C 1.532 0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.984 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.505 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 11.2 Cg_endo -53.65 157.18 10.25 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.753 2.302 . . . . 0.0 112.576 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.664 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.95 172.24 16.0 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.405 0.622 . . . . 0.0 111.694 -179.415 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.891 HG22 ' O ' ' A' ' 511' ' ' MET . 35.1 p -103.73 160.69 14.56 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 177.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.557 ' CG2' HD21 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -54.52 -43.72 72.14 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.057 -0.657 . . . . 0.0 110.487 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.855 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -61.24 -59.12 5.8 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.797 178.871 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -56.85 -20.44 22.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.581 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.74 HD11 HG13 ' A' ' 459' ' ' VAL . 1.6 tt -87.87 -42.4 12.55 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.015 0.436 . . . . 0.0 111.446 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.959 ' HB3' HD23 ' A' ' 493' ' ' LEU . 2.0 pp -84.38 -48.04 10.08 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.144 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 32.6 mmtt -48.83 -29.84 5.08 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -179.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.446 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -68.52 -41.68 79.61 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.932 -179.841 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.659 ' CE2' HG22 ' A' ' 454' ' ' VAL . 11.5 m-85 . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 111.021 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.911 ' CD2' HG11 ' A' ' 492' ' ' VAL . 1.6 tp . . . . . 0 N--CA 1.452 -0.334 0 CA-C-O 121.011 0.434 . . . . 0.0 111.088 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.33 151.29 0.37 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.66 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 m -59.96 -24.71 64.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.454 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -91.35 -45.78 8.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.553 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.764 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.5 mt-30 -63.46 -41.32 98.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.077 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.497 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 85.6 m -50.32 -30.28 11.69 Favored 'General case' 0 C--N 1.334 -0.087 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.807 HG22 HD13 ' A' ' 474' ' ' LEU . 5.0 t -83.62 -39.85 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.989 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 491' ' ' ASN . . . . . 0.426 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 4.9 t30 -61.04 -31.17 70.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.907 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.911 HG11 ' CD2' ' A' ' 484' ' ' LEU . 4.0 p -97.1 -12.49 8.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.861 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.959 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.3 OUTLIER -91.06 -40.9 11.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.176 0.512 . . . . 0.0 110.024 179.409 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.696 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -50.28 -36.64 32.35 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.257 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.9 OUTLIER -66.9 -42.87 84.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.297 -179.607 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.621 HG23 ' HA ' ' A' ' 456' ' ' GLU . 7.1 mt -77.74 -43.79 29.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.468 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.95 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -36.05 -57.67 0.69 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.729 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.664 ' HA ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -62.52 -22.77 66.55 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.29 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.514 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 1.4 mmp_? -60.14 -19.88 55.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.937 0.399 . . . . 0.0 110.69 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.028 HD22 HD11 ' A' ' 463' ' ' LEU . 16.4 mt -64.46 -47.92 77.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.044 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.582 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 56.81 59.07 8.21 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.403 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.582 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 73.9 Cg_endo -101.09 -160.22 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 124.02 3.147 . . . . 0.0 111.669 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.76 141.03 49.83 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.681 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.53 134.82 36.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.291 0.567 . . . . 0.0 111.591 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 10.9 mtmt -156.08 160.2 39.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.608 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -103.41 109.96 21.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.977 0.418 . . . . 0.0 111.699 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.515 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.73 110.81 22.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.869 178.896 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 58.35 44.53 18.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.975 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.5 t0 72.83 11.8 5.31 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.478 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 507' ' ' ILE . 1.8 tpmt? -116.08 128.81 55.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.606 0.241 . . . . 0.0 110.701 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.891 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -62.86 108.63 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.953 0.406 . . . . 0.0 110.581 180.0 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.806 ' CD2' HG23 ' A' ' 469' ' ' THR . 10.4 m170 -122.56 129.47 51.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.825 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.596 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -108.91 123.47 49.13 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.775 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.764 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.5 OUTLIER -177.89 169.34 2.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.059 0.457 . . . . 0.0 111.959 -178.57 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.737 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.5 pt? -114.12 169.13 9.25 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.468 179.111 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.4 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -137.57 106.71 6.02 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.052 0.453 . . . . 0.0 111.499 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.679 ' HG2' HG22 ' A' ' 464' ' ' THR . 3.8 pt-20 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.171 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.5 p30 . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.745 0.307 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -51.76 -47.15 64.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.033 0.444 . . . . 0.0 110.976 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 589' ' ' HIS . . . . . 0.467 ' CE1' ' HA ' ' A' ' 487' ' ' GLU . 4.6 p80 -80.13 -25.06 40.07 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.04 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.892 ' CD1' HD21 ' A' ' 474' ' ' LEU . 21.5 tp -58.94 -29.96 67.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.839 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 80.5 mt -85.86 -29.7 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.229 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.574 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.58 -38.13 88.64 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.799 -179.291 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.83 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.98 -17.9 54.6 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.153 0.502 . . . . 0.0 110.106 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.804 ' N ' HD13 ' B' ' 593' ' ' LEU . 1.1 pt-20 -61.8 -31.27 71.48 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.817 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 8.3 pt-20 -82.49 -47.13 12.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.406 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.687 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.1 pp -51.76 -26.74 7.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.018 0.437 . . . . 0.0 111.219 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.922 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.4 tp -68.47 -83.33 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.58 0.705 . . . . 0.0 111.516 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.674 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m . . . . . 0 N--CA 1.437 -1.115 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.43 -178.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.553 HG22 ' CD2' ' A' ' 477' ' ' PHE . 4.6 t . . . . . 0 CA--C 1.517 -0.324 0 CA-C-O 120.978 0.418 . . . . 0.0 110.707 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.724 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.6 p -131.58 159.65 37.6 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.552 0.692 . . . . 0.0 112.644 -179.097 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.654 ' HA ' HG23 ' A' ' 496' ' ' ILE . 19.8 mt-10 -54.73 -54.69 38.58 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.505 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.34 -28.35 42.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.924 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.416 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -80.22 -33.14 38.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.968 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.724 HG23 ' O ' ' A' ' 455' ' ' THR . 2.8 t -75.8 -36.04 32.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.768 0.318 . . . . 0.0 111.472 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.609 ' HD3' HD23 ' A' ' 500' ' ' LEU . 2.3 mmm-85 -57.46 -38.62 74.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.919 0.39 . . . . 0.0 110.088 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.453 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -70.31 -29.12 65.76 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.562 179.298 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.453 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 7.1 m-30 -64.83 -38.78 92.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.14 0.495 . . . . 0.0 109.813 179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.079 HD11 HD22 ' A' ' 500' ' ' LEU . 0.3 OUTLIER -73.97 -58.27 3.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.193 -179.63 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.764 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.89 -27.8 2.31 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 121.143 0.497 . . . . 0.0 110.478 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -87.57 -49.73 6.98 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.792 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.41 ' HA ' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -169.28 125.98 0.79 Allowed Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.138 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.551 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 9.2 Cg_endo -52.14 158.42 5.16 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.707 2.271 . . . . 0.0 112.878 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.681 ' CE ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -151.13 168.46 24.58 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-O 121.451 0.643 . . . . 0.0 111.968 -179.528 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.635 HG22 ' CD2' ' A' ' 512' ' ' HIS . 2.1 p -100.9 176.37 5.3 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 176.696 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.473 ' CG2' HD21 ' B' ' 593' ' ' LEU . 0.1 OUTLIER -71.04 -41.51 70.71 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 119.781 -0.767 . . . . 0.0 110.616 179.655 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.858 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -64.62 -49.69 70.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.669 178.659 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 472' ' ' ASP . . . . . 0.544 ' HA ' ' HD3' ' A' ' 475' ' ' LYS . 11.5 t70 -59.13 -40.1 84.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.247 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.69 HD11 ' CG1' ' A' ' 459' ' ' VAL . 1.0 OUTLIER -62.15 -41.27 98.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.096 0.474 . . . . 0.0 111.137 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.892 HD21 ' CD1' ' B' ' 590' ' ' LEU . 1.0 OUTLIER -84.46 -26.03 28.49 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.314 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.544 ' HD3' ' HA ' ' A' ' 472' ' ' ASP . 0.0 OUTLIER -54.85 -36.51 65.13 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.577 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.499 ' CE ' ' HA ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -81.38 -43.75 18.55 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.063 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.553 ' CD2' HG22 ' A' ' 454' ' ' VAL . 11.5 m-85 . . . . . 0 N--CA 1.451 -0.392 0 CA-C-O 121.288 0.566 . . . . 0.0 109.857 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.826 ' CD2' HG11 ' A' ' 492' ' ' VAL . 3.3 mp . . . . . 0 N--CA 1.446 -0.657 0 CA-C-O 121.004 0.431 . . . . 0.0 111.091 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -39.53 155.06 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.636 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 p -62.7 -20.39 64.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.463 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 487' ' ' GLU . . . . . 0.467 ' HA ' ' CE1' ' B' ' 589' ' ' HIS . 4.0 mt-10 -95.48 -39.95 9.72 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.748 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.624 ' O ' HG12 ' A' ' 492' ' ' VAL . 14.0 mt-30 -69.26 -43.76 73.29 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.568 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 90.1 m -49.18 -28.99 4.93 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 121.271 0.558 . . . . 0.0 109.839 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.622 HG22 HD22 ' A' ' 474' ' ' LEU . 17.4 t -84.28 -39.98 15.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.631 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 491' ' ' ASN . . . . . 0.46 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 9.4 t30 -60.99 -29.91 69.97 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.975 178.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.826 HG11 ' CD2' ' A' ' 484' ' ' LEU . 7.6 p -97.48 -13.14 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.938 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.834 HD23 ' HB3' ' A' ' 474' ' ' LEU . 5.6 tp -90.95 -43.76 9.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.129 0.49 . . . . 0.0 110.107 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.717 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -49.29 -33.87 14.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.543 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.9 OUTLIER -69.09 -43.19 75.0 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.877 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.654 HG23 ' HA ' ' A' ' 456' ' ' GLU . 6.4 mt -78.93 -32.43 15.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -178.56 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.922 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -46.05 -57.72 4.21 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.679 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.687 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.96 -29.19 68.25 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -178.26 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.553 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 4.0 mmm180 -58.29 -22.08 51.46 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.91 0.386 . . . . 0.0 110.681 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.079 HD22 HD11 ' A' ' 463' ' ' LEU . 65.2 mt -58.74 -47.62 83.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.529 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.615 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.1 t-20 56.48 57.45 9.02 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.507 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.615 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.9 Cg_endo -101.74 -163.26 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.44 0 C-N-CA 124.175 3.25 . . . . 0.0 111.843 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 503' ' ' GLU . . . . . 0.406 ' O ' ' CD ' ' A' ' 505' ' ' LYS . 0.1 OUTLIER -116.39 145.07 43.52 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.038 178.51 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -83.24 132.91 35.02 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.404 0.621 . . . . 0.0 111.985 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.406 ' CD ' ' O ' ' A' ' 503' ' ' GLU . 0.0 OUTLIER -150.32 159.67 44.29 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.455 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.461 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 0.0 OUTLIER -105.1 112.17 25.21 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.605 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.468 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.7 OUTLIER -90.89 110.92 22.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.025 179.237 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.7 t30 58.85 41.99 20.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.764 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 509' ' ' ASP . . . . . 0.461 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 1.3 t70 74.37 14.89 3.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.252 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' A' ' 506' ' ' MET . 0.0 OUTLIER -116.26 131.61 56.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 110.908 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.488 ' HA ' ' HE3' ' A' ' 511' ' ' MET . 3.7 tpt -62.54 108.4 1.13 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.93 0.395 . . . . 0.0 110.687 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.635 ' CD2' HG22 ' A' ' 469' ' ' THR . 10.4 m170 -122.84 128.81 50.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.408 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.639 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.73 123.36 48.02 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.701 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.813 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.6 OUTLIER 179.11 169.13 0.97 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.107 0.48 . . . . 0.0 111.985 -178.857 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.758 ' CD2' HD12 ' A' ' 463' ' ' LEU . 1.6 pt? -114.04 169.17 9.21 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.382 178.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -142.42 106.52 4.74 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.083 0.468 . . . . 0.0 111.382 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.764 ' HB2' HG22 ' A' ' 464' ' ' THR . 2.7 mm-40 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.847 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.307 0 CA-C-O 120.737 0.303 . . . . 0.0 111.763 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -53.33 -55.21 26.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.011 0.434 . . . . 0.0 111.73 -179.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 589' ' ' HIS . . . . . 0.677 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.6 p80 -77.08 -21.63 54.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.334 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 1.078 HD13 HD21 ' A' ' 474' ' ' LEU . 24.3 tp -60.6 -29.52 69.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.544 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 79.0 mt -85.75 -34.32 8.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.677 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.78 -40.89 68.93 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.359 -0.537 . . . . 0.0 112.161 -178.901 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.808 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -66.5 -18.54 65.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.103 0.478 . . . . 0.0 110.246 -179.762 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.771 ' HA ' HG21 ' A' ' 470' ' ' THR . 4.1 pt-20 -63.4 -30.87 71.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.597 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.1 -47.97 17.08 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.126 -179.115 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.615 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.1 pp -52.33 -26.59 9.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.214 0.531 . . . . 0.0 110.89 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.913 HD22 ' HG ' ' A' ' 497' ' ' LEU . 13.1 tp -69.61 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.483 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.772 HG22 ' HG ' ' B' ' 597' ' ' LEU . 34.4 m . . . . . 0 N--CA 1.439 -1.014 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.65 -178.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.865 HG22 ' CD2' ' A' ' 477' ' ' PHE . 79.0 t . . . . . 0 CA--C 1.515 -0.38 0 CA-C-O 120.902 0.382 . . . . 0.0 110.555 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.603 ' O ' HG23 ' A' ' 459' ' ' VAL . 23.4 p -131.52 157.78 42.66 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 121.556 0.693 . . . . 0.0 112.481 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.822 ' HA ' HG23 ' A' ' 496' ' ' ILE . 22.9 mt-10 -51.38 -53.36 37.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.475 -1.239 . . . . 0.0 110.941 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.71 -31.46 72.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.56 -179.151 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.437 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -71.37 -36.69 71.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.396 -179.439 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.798 ' HB ' HD21 ' A' ' 500' ' ' LEU . 16.4 t -72.31 -25.7 23.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.121 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.2 OUTLIER -63.11 -51.04 68.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.109 0.48 . . . . 0.0 109.814 178.769 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.485 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -54.93 -28.09 48.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 179.394 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.505 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 12.9 m-30 -68.81 -45.31 71.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.148 179.079 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.808 HD11 HD22 ' A' ' 500' ' ' LEU . 0.7 OUTLIER -68.47 -57.4 5.88 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.238 179.704 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.71 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.84 -24.51 1.47 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.789 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.572 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 24.4 ttp180 -93.35 -31.33 14.7 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.531 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.572 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER 169.89 162.7 0.2 Allowed Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.662 -179.588 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.681 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 73.9 Cg_endo -72.0 163.31 39.2 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.341 2.027 . . . . 0.0 113.34 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.751 ' SD ' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -152.15 152.64 32.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.383 -178.794 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.714 HG23 ' CE1' ' A' ' 512' ' ' HIS . 0.6 OUTLIER -95.9 162.4 13.59 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.021 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.771 HG21 ' HA ' ' B' ' 594' ' ' GLU . 1.8 p -65.3 -34.11 77.57 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.853 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.846 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -73.63 -50.91 18.73 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.35 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -59.73 -19.68 51.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.228 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.764 HD13 HD11 ' A' ' 497' ' ' LEU . 0.4 OUTLIER -75.24 -41.25 57.91 Favored 'General case' 0 C--O 1.23 0.051 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.133 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 1.078 HD21 HD13 ' B' ' 590' ' ' LEU . 1.3 pp -84.33 -46.53 11.66 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 37.4 mmtt -46.69 -29.23 1.78 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.773 0.32 . . . . 0.0 111.479 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.488 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -78.06 -41.24 36.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.642 179.547 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.865 ' CD2' HG22 ' A' ' 454' ' ' VAL . 16.5 m-85 . . . . . 0 N--CA 1.452 -0.339 0 CA-C-O 121.298 0.57 . . . . 0.0 110.073 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.911 ' CD2' HG11 ' A' ' 492' ' ' VAL . 4.3 mp . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 120.961 0.41 . . . . 0.0 111.279 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.26 156.72 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.729 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 486' ' ' SER . . . . . 0.4 ' O ' HG23 ' A' ' 490' ' ' VAL . 1.0 OUTLIER -62.26 -24.13 67.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.09 178.861 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -88.84 -48.35 7.54 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.577 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.701 ' O ' HG12 ' A' ' 492' ' ' VAL . 3.1 mt-30 -60.42 -43.25 96.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.997 179.438 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 92.7 m -49.43 -29.36 6.33 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 121.111 0.481 . . . . 0.0 109.785 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 1.012 HG22 HD22 ' A' ' 474' ' ' LEU . 8.2 t -83.55 -40.97 16.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.937 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 491' ' ' ASN . . . . . 0.411 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 3.3 t30 -60.96 -29.78 69.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.98 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.911 HG11 ' CD2' ' A' ' 484' ' ' LEU . 6.8 p -99.03 -6.97 9.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.823 179.312 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.704 ' CD1' HD22 ' A' ' 497' ' ' LEU . 9.6 tp -94.88 -34.58 12.38 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.003 0.43 . . . . 0.0 110.483 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.538 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -61.29 -37.02 81.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.109 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.463 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.5 OUTLIER -66.45 -45.27 80.34 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.849 -179.483 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.822 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.9 mt -73.93 -40.15 52.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.79 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.913 ' HG ' HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -38.82 -63.04 0.55 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.891 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.645 ' HA ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.5 -27.99 66.65 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -58.81 -21.06 55.44 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.083 0.468 . . . . 0.0 110.992 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.808 HD22 HD11 ' A' ' 463' ' ' LEU . 84.5 mt -61.67 -47.76 83.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.503 -179.318 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.59 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.9 t-20 60.95 57.67 3.59 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.04 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.59 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 58.5 Cg_endo -101.22 -160.63 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 124.291 3.327 . . . . 0.0 111.771 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.95 138.21 54.5 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.782 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.68 133.61 36.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.388 0.613 . . . . 0.0 111.719 -178.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -156.33 146.99 21.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.81 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.458 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 0.0 OUTLIER -89.22 111.26 22.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.94 0.4 . . . . 0.0 111.362 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.53 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.78 110.93 22.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.172 179.299 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 1.5 t30 60.06 41.85 16.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.906 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 509' ' ' ASP . . . . . 0.458 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 3.9 t0 74.22 13.82 3.87 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.223 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 506' ' ' MET . 0.0 OUTLIER -116.08 130.64 56.9 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.838 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.675 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -60.51 108.7 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 0.0 110.718 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.714 ' CE1' HG23 ' A' ' 469' ' ' THR . 19.4 m80 -122.58 155.75 35.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.673 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.746 ' CD1' HD21 ' B' ' 597' ' ' LEU . 5.3 p90 -134.29 123.69 24.62 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.757 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.681 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER 179.77 169.43 1.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.391 0.615 . . . . 0.0 112.03 -178.99 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.811 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -118.54 168.86 10.28 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.425 178.454 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.406 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -135.07 106.02 6.61 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.167 0.508 . . . . 0.0 111.165 179.369 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.71 ' HG2' HG22 ' A' ' 464' ' ' THR . 1.8 pt-20 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.023 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.277 0 CA-C-O 120.739 0.304 . . . . 0.0 111.784 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -52.72 -55.16 24.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.091 0.472 . . . . 0.0 111.56 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 589' ' ' HIS . . . . . 0.409 ' HA ' ' HB3' ' B' ' 592' ' ' TYR . 1.6 p80 -79.7 -21.89 44.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.181 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.87 ' CD1' HD21 ' A' ' 474' ' ' LEU . 28.2 tp -52.0 -39.81 60.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.043 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 54.5 mt -86.06 -29.71 6.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.134 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.559 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.57 -39.61 84.9 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.45 -179.781 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.804 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.52 -18.0 55.38 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.156 0.503 . . . . 0.0 109.92 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.75 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.4 OUTLIER -63.43 -30.76 71.84 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.974 179.709 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 6.5 pt-20 -80.73 -47.41 14.0 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.721 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.5 pp -50.15 -26.54 3.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.138 0.494 . . . . 0.0 110.991 179.616 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.972 HD13 ' HB3' ' A' ' 497' ' ' LEU . 11.9 tp -64.63 -83.77 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.307 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.74 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.8 m . . . . . 0 N--CA 1.436 -1.147 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.188 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.525 HG22 ' CE2' ' A' ' 477' ' ' PHE . 7.5 t . . . . . 0 CA--C 1.514 -0.418 0 CA-C-O 121.019 0.438 . . . . 0.0 110.636 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.504 ' O ' HG23 ' A' ' 459' ' ' VAL . 23.2 p -132.02 164.29 26.52 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.539 0.685 . . . . 0.0 112.192 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.701 ' HA ' HG23 ' A' ' 496' ' ' ILE . 18.6 mt-10 -57.33 -53.47 57.79 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.506 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.99 -29.22 63.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.07 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.406 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -74.6 -35.06 62.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.644 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.754 ' CG1' HD21 ' A' ' 500' ' ' LEU . 14.2 t -76.02 -28.36 18.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 120.859 -0.337 . . . . 0.0 111.511 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -62.73 -50.82 69.57 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.98 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.46 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -55.43 -27.04 45.46 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.356 179.053 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.507 ' O ' ' O ' ' A' ' 466' ' ' LYS . 11.4 m-30 -68.38 -44.44 75.14 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.527 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.084 HD11 HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -70.58 -54.36 12.36 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.099 179.318 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.448 HG22 ' CG ' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.09 -24.65 1.17 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.673 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.606 ' O ' ' HG2' ' A' ' 466' ' ' LYS . 3.5 ptp85 -97.04 -47.84 5.63 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.336 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.689 ' HD3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -165.77 166.79 9.64 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 122.316 0.247 . . . . 0.0 110.708 179.905 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.689 ' HD2' ' HD3' ' A' ' 466' ' ' LYS . 97.0 Cg_endo -77.15 162.86 31.17 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.276 1.984 . . . . 0.0 113.551 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.706 ' SD ' HD11 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -156.14 151.16 26.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.168 -178.74 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.673 HG22 ' O ' ' A' ' 511' ' ' MET . 10.9 p -99.11 175.06 6.03 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.506 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.6 OUTLIER -71.31 -31.52 67.53 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.333 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.85 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -77.0 -53.52 7.72 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.325 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -57.89 -19.94 33.2 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.757 178.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.883 HD12 HD11 ' A' ' 497' ' ' LEU . 6.8 mt -77.27 -40.92 42.94 Favored 'General case' 0 C--O 1.23 0.054 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.895 HD22 HG22 ' A' ' 490' ' ' VAL . 1.6 pp -84.22 -47.37 10.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.562 ' N ' HD12 ' A' ' 474' ' ' LEU . 18.0 mmtp -46.85 -28.33 1.53 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.698 0.285 . . . . 0.0 111.484 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.52 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -79.56 -41.03 28.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.653 179.545 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.525 ' CE2' HG22 ' A' ' 454' ' ' VAL . 16.8 m-85 . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 121.529 0.681 . . . . 0.0 110.053 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.906 HD23 HG11 ' A' ' 492' ' ' VAL . 1.5 mp . . . . . 0 N--CA 1.451 -0.395 0 CA-C-O 120.919 0.39 . . . . 0.0 111.422 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.93 154.23 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.82 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 486' ' ' SER . . . . . 0.533 ' O ' HG23 ' A' ' 490' ' ' VAL . 74.2 m -61.15 -26.41 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.139 179.002 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -84.61 -53.28 5.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.443 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.581 ' O ' HG12 ' A' ' 492' ' ' VAL . 0.9 OUTLIER -59.66 -40.48 87.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.023 179.392 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 44.2 m -51.43 -31.06 21.62 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.895 HG22 HD22 ' A' ' 474' ' ' LEU . 2.5 t -78.86 -42.59 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.309 179.321 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.51 -34.05 72.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.897 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.906 HG11 HD23 ' A' ' 484' ' ' LEU . 7.3 p -93.7 -10.46 9.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.75 179.146 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.588 ' HG ' HD23 ' A' ' 497' ' ' LEU . 21.2 tp -90.24 -44.39 9.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.092 0.473 . . . . 0.0 110.554 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.716 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -51.61 -33.9 35.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.69 -179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -41.9 78.34 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.216 -179.093 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.701 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.5 mt -79.13 -29.95 14.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.972 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.3 OUTLIER -47.63 -58.35 4.38 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.489 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.721 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.42 -28.05 66.59 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -177.856 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.556 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.5 mmm180 -60.38 -20.84 61.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.057 0.456 . . . . 0.0 110.19 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.084 HD22 HD11 ' A' ' 463' ' ' LEU . 77.4 mt -59.59 -47.61 84.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.037 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.634 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 28.0 t-20 55.36 54.5 9.71 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.164 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.634 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 69.7 Cg_endo -101.25 -160.15 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 124.071 3.181 . . . . 0.0 111.596 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.19 140.44 50.19 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.834 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.7 133.57 36.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.316 0.579 . . . . 0.0 111.477 -178.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -156.36 132.11 9.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.989 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.18 108.86 13.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.876 0.369 . . . . 0.0 111.396 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.469 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.61 110.8 22.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.938 179.047 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 66.2 t30 59.64 43.9 15.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.857 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.6 t0 72.4 13.29 5.54 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.279 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.416 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.08 128.44 55.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.777 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.673 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -60.98 108.65 0.9 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.041 0.448 . . . . 0.0 110.519 179.838 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.547 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 24.7 m80 -122.8 132.82 54.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.211 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.639 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.0 OUTLIER -108.51 123.77 49.41 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.788 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.583 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER -171.82 169.69 5.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.556 0.693 . . . . 0.0 112.762 -178.735 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.817 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -129.19 168.92 15.46 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.341 178.401 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.44 105.78 7.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.064 0.459 . . . . 0.0 110.9 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.448 ' CG ' HG22 ' A' ' 464' ' ' THR . 39.3 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.918 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 587' ' ' ASP . . . . . 0.53 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 120.813 0.339 . . . . 0.0 111.566 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -53.45 -55.16 27.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.077 0.465 . . . . 0.0 111.561 -179.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -80.01 -21.81 43.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.235 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 1.021 ' CD1' HD21 ' A' ' 474' ' ' LEU . 39.1 tp -48.63 -29.54 4.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.299 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 591' ' ' ILE . . . . . 0.527 HG23 ' OE1' ' B' ' 594' ' ' GLU . 79.1 mt -85.61 -29.77 6.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.216 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.574 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.48 -52.13 65.77 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.15 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.806 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -66.51 -17.94 65.09 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.497 -179.612 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.527 ' OE1' HG23 ' B' ' 591' ' ' ILE . 1.0 OUTLIER -62.28 -30.87 71.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.968 -179.682 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.403 ' CG ' ' O ' ' B' ' 592' ' ' TYR . 1.6 pt-20 -82.52 -43.73 16.79 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.591 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -53.86 -26.5 14.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.097 0.475 . . . . 0.0 111.172 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.909 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.6 tp -71.1 -82.65 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.557 0.694 . . . . 0.0 112.041 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.669 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.4 m . . . . . 0 N--CA 1.438 -1.073 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.627 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.789 HG22 ' CD2' ' A' ' 477' ' ' PHE . 59.3 t . . . . . 0 CA--C 1.516 -0.36 0 CA-C-O 120.844 0.355 . . . . 0.0 110.648 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.446 ' O ' HG23 ' A' ' 459' ' ' VAL . 25.4 p -131.65 163.36 28.28 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.642 0.734 . . . . 0.0 112.503 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.787 ' HA ' HG23 ' A' ' 496' ' ' ILE . 22.3 mt-10 -58.56 -52.57 65.1 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.51 -1.223 . . . . 0.0 110.933 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.03 -27.49 68.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.581 -178.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.474 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -70.07 -58.18 4.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.738 0.304 . . . . 0.0 111.62 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.918 ' HB ' HD21 ' A' ' 500' ' ' LEU . 16.9 t -48.17 -31.72 3.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.946 0.403 . . . . 0.0 110.9 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.572 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -54.69 -47.99 72.98 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.259 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -63.35 -27.88 69.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.507 179.452 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.512 ' CE2' ' CE2' ' A' ' 477' ' ' PHE . 8.2 m-30 -68.78 -42.9 76.76 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.289 0.566 . . . . 0.0 109.649 178.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.089 HD11 HD13 ' A' ' 500' ' ' LEU . 3.7 mt -70.35 -60.29 2.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.964 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.661 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.1 OUTLIER -49.44 -24.43 1.99 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.065 -179.569 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -92.93 -46.04 7.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.508 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.489 ' HD2' ' HD2' ' A' ' 467' ' ' PRO . 1.4 mmmt -165.2 128.8 1.67 Allowed Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.005 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.564 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 18.0 Cg_endo -56.17 146.09 72.85 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.358 2.039 . . . . 0.0 112.716 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.629 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -132.78 178.23 7.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.278 -179.276 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.571 HG22 ' O ' ' A' ' 511' ' ' MET . 10.1 p -124.16 160.71 27.24 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.094 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.586 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.7 OUTLIER -58.22 -30.84 66.82 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.192 -0.603 . . . . 0.0 111.251 -179.174 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 1.012 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -76.53 -50.84 12.93 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.823 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 472' ' ' ASP . . . . . 0.432 ' HA ' ' CD ' ' A' ' 475' ' ' LYS . 11.9 t70 -64.79 -31.04 72.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.86 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.767 HD13 HD11 ' A' ' 493' ' ' LEU . 0.5 OUTLIER -60.13 -42.36 94.62 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.164 0.507 . . . . 0.0 110.985 -179.558 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 1.021 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.9 pp -85.24 -25.03 27.53 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.555 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.477 ' HD2' ' O ' ' A' ' 471' ' ' LYS . 4.1 mttt -46.05 -36.32 5.62 Favored 'General case' 0 N--CA 1.461 0.109 0 N-CA-C 111.628 0.232 . . . . 0.0 111.628 -178.523 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.527 ' HE3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -93.43 -43.23 8.85 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.135 179.573 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.789 ' CD2' HG22 ' A' ' 454' ' ' VAL . 3.0 m-85 . . . . . 0 N--CA 1.45 -0.44 0 CA-C-O 121.381 0.61 . . . . 0.0 110.158 179.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 1.004 HD23 HG11 ' A' ' 492' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.448 -0.562 0 CA-C-O 121.107 0.479 . . . . 0.0 111.407 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.51 161.09 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.496 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 98.9 p -60.89 -24.98 66.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.021 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -91.02 -43.51 9.89 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.349 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.663 ' O ' HG12 ' A' ' 492' ' ' VAL . 2.0 mt-30 -64.08 -41.24 97.39 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.918 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 91.8 m -51.75 -27.7 12.9 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.714 178.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.783 HG22 HD22 ' A' ' 474' ' ' LEU . 6.6 t -84.94 -40.37 14.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.813 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -61.09 -32.0 71.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.911 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 1.004 HG11 HD23 ' A' ' 484' ' ' LEU . 7.7 p -94.01 -11.15 9.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.752 179.227 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.767 HD11 HD13 ' A' ' 473' ' ' LEU . 21.8 tp -89.85 -43.04 10.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.216 0.531 . . . . 0.0 110.204 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.573 ' HB2' ' HB2' ' B' ' 593' ' ' LEU . . . -51.97 -33.54 38.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.658 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.23 -42.88 79.11 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.891 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.787 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.9 mt -72.86 -45.28 56.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -178.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.909 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.7 OUTLIER -37.38 -64.01 0.4 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.6 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.591 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.61 -27.06 65.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.991 0.424 . . . . 0.0 111.261 -179.282 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.71 -26.5 68.7 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.547 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.089 HD13 HD11 ' A' ' 463' ' ' LEU . 67.3 mt -60.36 -47.37 86.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.918 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.56 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 59.12 59.69 5.13 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.732 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.56 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 91.7 Cg_endo -101.19 -159.25 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.326 0 C-N-CA 124.04 3.16 . . . . 0.0 111.317 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.39 141.53 48.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.738 178.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -79.47 134.23 36.53 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.321 0.581 . . . . 0.0 111.292 -179.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -156.12 157.95 36.87 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.857 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.441 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.8 OUTLIER -105.19 109.94 22.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.93 0.395 . . . . 0.0 111.532 -179.757 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.488 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.72 110.79 22.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.867 178.994 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 59.51 44.41 14.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.739 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 6.5 t0 71.16 13.83 6.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.257 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.45 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.15 134.69 54.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.784 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.571 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -65.78 108.74 2.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.937 0.399 . . . . 0.0 110.88 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.508 ' CE1' ' CG2' ' A' ' 469' ' ' THR . 25.6 m80 -123.05 130.7 53.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.093 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.63 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -105.0 125.44 50.98 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.092 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.564 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER -175.29 169.33 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.78 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.703 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.2 pt? -122.74 169.14 11.38 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.062 178.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.79 106.75 8.31 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.434 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.661 ' HG2' HG22 ' A' ' 464' ' ' THR . 6.1 pt-20 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.044 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 587' ' ' ASP . . . . . 0.412 ' O ' ' HB3' ' B' ' 590' ' ' LEU . 1.1 p30 . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.814 0.34 . . . . 0.0 111.554 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -57.51 -40.8 79.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.899 0.381 . . . . 0.0 111.413 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -80.32 -21.87 42.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.724 -179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.938 ' CD1' HD21 ' A' ' 474' ' ' LEU . 16.6 tp -53.5 -31.05 44.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.957 0.408 . . . . 0.0 110.72 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.7 mt -85.76 -29.59 6.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.892 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.578 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.42 -38.74 92.1 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.809 -179.441 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.824 HD13 ' N ' ' B' ' 594' ' ' GLU . 0.0 OUTLIER -78.39 -18.0 55.65 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.191 0.52 . . . . 0.0 109.988 -179.887 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.824 ' N ' HD13 ' B' ' 593' ' ' LEU . 1.1 pt-20 -62.37 -30.75 71.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.844 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 7.5 pt-20 -82.2 -48.49 11.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.316 -179.101 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.734 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -52.39 -26.8 9.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.22 0.533 . . . . 0.0 111.211 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.994 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.8 tp -60.87 -84.86 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.343 -0.844 . . . . 0.0 113.027 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.739 HG13 ' HG ' ' B' ' 597' ' ' LEU . 34.8 m . . . . . 0 N--CA 1.436 -1.156 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.679 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.866 HG22 ' CD2' ' A' ' 477' ' ' PHE . 93.1 t . . . . . 0 CA--C 1.516 -0.349 0 CA-C-O 120.878 0.37 . . . . 0.0 110.564 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.473 ' O ' HG23 ' A' ' 459' ' ' VAL . 23.6 p -131.49 163.66 27.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.634 0.73 . . . . 0.0 112.361 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.809 ' HA ' HG23 ' A' ' 496' ' ' ILE . 21.7 mt-10 -57.99 -53.08 62.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.67 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.49 -28.09 68.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.0 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -67.51 -58.07 5.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.828 0.346 . . . . 0.0 111.36 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.86 ' HB ' HD21 ' A' ' 500' ' ' LEU . 21.2 t -50.58 -28.83 6.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.581 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.508 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.9 OUTLIER -58.5 -45.49 88.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.978 0.418 . . . . 0.0 110.434 179.036 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.439 ' HG2' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -60.87 -25.38 66.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.929 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.525 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 8.8 m-30 -77.83 -39.74 42.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.832 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.827 HD11 HD22 ' A' ' 500' ' ' LEU . 0.9 OUTLIER -70.08 -61.4 1.79 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.233 179.914 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.751 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.1 OUTLIER -48.37 -27.27 2.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.093 0.473 . . . . 0.0 110.563 179.783 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 45.1 ttp180 -87.1 -50.32 6.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.907 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.419 ' HD2' ' HD2' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -167.46 128.28 1.18 Allowed Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.612 -179.839 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.621 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 9.0 Cg_endo -48.78 169.7 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.234 1.956 . . . . 0.0 112.502 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.523 ' SD ' HD22 ' A' ' 463' ' ' LEU . 0.0 OUTLIER -156.42 -178.55 7.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.601 0.715 . . . . 0.0 111.88 -178.801 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 469' ' ' THR . . . . . 1.016 HG23 ' CD2' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -119.84 170.61 9.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.59 -1.186 . . . . 0.0 107.818 177.744 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.509 HG23 HD22 ' B' ' 597' ' ' LEU . 0.6 OUTLIER -71.15 -32.86 69.47 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.074 -0.65 . . . . 0.0 110.612 179.682 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.785 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -76.86 -46.66 23.79 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.461 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -64.25 -20.53 66.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.534 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.758 HD12 HD11 ' A' ' 497' ' ' LEU . 4.8 mt -78.39 -37.23 44.53 Favored 'General case' 0 C--N 1.334 -0.081 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.998 HD22 HG22 ' A' ' 490' ' ' VAL . 1.4 pp -82.46 -49.51 9.86 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.132 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.616 ' N ' HD12 ' A' ' 474' ' ' LEU . 16.1 mmtp -46.72 -28.84 1.64 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -75.76 -43.0 48.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.921 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.866 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.5 m-85 . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.475 0.655 . . . . 0.0 110.294 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 1.005 HD23 HG11 ' A' ' 492' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 120.953 0.406 . . . . 0.0 111.096 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.12 160.82 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.532 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 486' ' ' SER . . . . . 0.412 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.2 OUTLIER -59.85 -23.93 63.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.162 0.506 . . . . 0.0 109.741 178.558 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -89.77 -51.4 5.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.167 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.721 ' O ' HG12 ' A' ' 492' ' ' VAL . 5.6 mt-30 -59.06 -41.68 88.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.019 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 91.9 m -50.61 -30.5 13.5 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.715 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.998 HG22 HD22 ' A' ' 474' ' ' LEU . 3.4 t -82.57 -40.59 16.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.184 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -60.37 -30.74 69.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.962 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 1.005 HG11 HD23 ' A' ' 484' ' ' LEU . 5.6 p -99.01 -6.94 9.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.835 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.781 HD11 HD22 ' A' ' 497' ' ' LEU . 13.8 tp -94.29 -40.79 9.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.032 0.444 . . . . 0.0 110.557 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.693 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -54.67 -38.02 66.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.442 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -41.92 95.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.935 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.809 HG23 ' HA ' ' A' ' 456' ' ' GLU . 13.7 mt -77.75 -48.17 24.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.994 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -31.58 -64.05 0.16 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.487 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.734 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -60.18 -29.82 68.95 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.415 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -55.52 -23.3 25.57 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.971 0.415 . . . . 0.0 111.036 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.86 HD21 ' HB ' ' A' ' 459' ' ' VAL . 16.0 mt -63.1 -47.45 82.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.654 -179.565 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.558 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 60.68 59.83 3.65 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.013 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.558 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 53.1 Cg_endo -99.78 -159.24 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 123.983 3.122 . . . . 0.0 111.6 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.55 140.19 51.83 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.828 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.59 134.89 36.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.369 0.604 . . . . 0.0 111.713 -178.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -156.22 160.08 39.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.588 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.56 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 8.6 ptm -97.79 109.95 22.61 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.137 0.494 . . . . 0.0 111.589 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.552 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.3 OUTLIER -90.63 110.92 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.852 179.103 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.37 38.77 19.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.719 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 509' ' ' ASP . . . . . 0.56 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 5.2 t70 77.86 10.15 2.21 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.573 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.447 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.24 134.23 55.14 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.619 0.247 . . . . 0.0 111.088 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.459 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.04 108.61 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.098 0.475 . . . . 0.0 111.004 -179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 1.016 ' CD2' HG23 ' A' ' 469' ' ' THR . 6.4 m170 -122.62 148.37 45.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.436 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.628 ' CZ ' HD23 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -126.1 123.31 38.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.245 179.666 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.769 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.3 OUTLIER -176.68 169.3 2.54 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.142 0.496 . . . . 0.0 111.945 -179.129 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.765 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.6 pt? -114.24 169.15 9.24 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.404 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.419 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -142.35 106.43 4.74 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.029 0.443 . . . . 0.0 111.378 179.683 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.751 ' HB2' HG22 ' A' ' 464' ' ' THR . 28.6 mm-40 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.826 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 120.742 0.306 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.87 -47.28 64.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.962 0.411 . . . . 0.0 111.376 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 3.4 p80 -80.07 -21.85 42.93 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.238 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.907 ' CD1' HD21 ' A' ' 474' ' ' LEU . 26.1 tp -62.95 -43.61 98.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.793 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 591' ' ' ILE . . . . . 0.408 ' O ' ' HB3' ' B' ' 594' ' ' GLU . 51.3 mt -86.13 -29.55 6.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 120.813 0.34 . . . . 0.0 111.009 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.567 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -63.28 -44.97 93.55 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.643 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 1.039 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -69.69 -19.72 63.57 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.38 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.721 ' N ' HD13 ' B' ' 593' ' ' LEU . 10.6 tt0 -63.13 -30.86 71.93 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.337 179.298 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.32 -44.45 62.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.495 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 1.05 HD11 ' HB1' ' A' ' 494' ' ' ALA . 4.8 pt -58.17 -26.64 30.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.184 0.516 . . . . 0.0 110.963 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.825 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.0 tp -72.73 -81.78 0.05 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.04 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.708 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.0 m . . . . . 0 N--CA 1.438 -1.054 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.731 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.468 HG22 ' CE2' ' A' ' 477' ' ' PHE . 0.9 OUTLIER . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 120.964 0.412 . . . . 0.0 110.796 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.559 ' O ' HG23 ' A' ' 459' ' ' VAL . 27.4 p -131.65 169.87 15.55 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.557 0.694 . . . . 0.0 112.654 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.596 ' HA ' HG23 ' A' ' 496' ' ' ILE . 20.6 mt-10 -69.13 -54.7 13.59 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.271 179.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.96 -26.76 6.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.758 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.431 ' O ' ' CD1' ' A' ' 462' ' ' TYR . . . -77.16 -35.54 55.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.85 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.779 HG13 HD11 ' A' ' 473' ' ' LEU . 4.0 t -76.1 -40.15 36.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.876 0.37 . . . . 0.0 111.392 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.571 ' CD ' HD23 ' A' ' 500' ' ' LEU . 1.6 mmm180 -53.99 -39.24 65.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.254 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.449 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -70.8 -28.83 64.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.614 179.334 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.449 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 14.2 m-30 -65.69 -36.95 85.1 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.084 HD11 HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -74.27 -55.96 5.44 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.838 179.718 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.815 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -50.48 -25.36 3.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.679 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 466' ' ' LYS . 24.6 ptt180 -92.99 -39.45 11.1 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.223 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -176.73 132.24 0.38 Allowed Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 120.72 0.295 . . . . 0.0 111.044 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.585 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 18.0 Cg_endo -58.06 152.47 51.48 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.752 2.301 . . . . 0.0 113.41 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.843 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.09 161.36 42.51 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.507 -179.505 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.765 HG22 ' O ' ' A' ' 511' ' ' MET . 11.6 p -96.62 -178.41 4.25 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.391 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 470' ' ' THR . . . . . 1.039 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -71.06 -44.71 65.2 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.687 -0.805 . . . . 0.0 110.88 179.593 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.823 ' HB3' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -62.32 -51.88 65.88 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.995 179.284 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 472' ' ' ASP . . . . . 0.413 ' H ' ' HG2' ' A' ' 471' ' ' LYS . 36.4 t70 -57.85 -26.71 62.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.388 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.843 HD12 ' CG ' ' A' ' 468' ' ' MET . 1.0 OUTLIER -83.05 -41.52 18.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.104 0.478 . . . . 0.0 111.37 -179.654 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.975 ' HB3' HD23 ' A' ' 493' ' ' LEU . 2.6 pp -83.98 -25.94 29.62 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -178.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.491 ' HD2' ' HB2' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -48.24 -33.59 8.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.685 0.279 . . . . 0.0 111.607 -178.986 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.482 ' HE2' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -87.5 -43.11 12.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.41 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.482 ' CD2' ' HE2' ' A' ' 476' ' ' LYS . 3.8 m-85 . . . . . 0 N--CA 1.454 -0.242 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.401 ' HB3' ' OG1' ' A' ' 489' ' ' THR . 0.4 OUTLIER . . . . . 0 N--CA 1.451 -0.385 0 CA-C-O 120.857 0.361 . . . . 0.0 111.058 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.42 150.83 0.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.916 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 486' ' ' SER . . . . . 0.479 ' O ' HG23 ' A' ' 490' ' ' VAL . 6.3 t -61.43 -23.09 65.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.373 179.233 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -90.94 -48.44 7.0 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.598 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -45.18 94.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.257 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 91.1 m -49.56 -35.37 20.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.132 179.345 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.694 HG13 HD22 ' A' ' 474' ' ' LEU . 2.2 t -75.75 -44.1 39.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.078 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.15 -26.2 49.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.082 179.095 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.404 ' O ' ' HG3' ' A' ' 495' ' ' GLN . 8.7 p -102.17 -15.29 7.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.085 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.975 HD23 ' HB3' ' A' ' 474' ' ' LEU . 1.8 tp -89.04 -42.52 11.7 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.106 0.479 . . . . 0.0 110.823 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 1.05 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -51.29 -37.12 45.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.604 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.33 -37.88 89.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.668 -179.506 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.596 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.0 mt -78.73 -42.52 25.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.825 ' HB3' HD13 ' B' ' 597' ' ' LEU . 3.2 mm? -41.83 -50.4 4.39 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.832 ' NZ ' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -61.18 -25.62 67.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.834 0.349 . . . . 0.0 111.593 -179.157 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.484 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 9.1 mmp_? -64.16 -19.04 65.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.969 0.414 . . . . 0.0 110.478 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.084 HD22 HD11 ' A' ' 463' ' ' LEU . 64.8 mt -62.13 -47.48 84.4 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.839 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.614 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.3 t-20 54.66 57.08 11.95 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.334 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.614 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 83.1 Cg_endo -102.24 -159.75 0.04 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.454 0 C-N-CA 123.967 3.111 . . . . 0.0 111.672 -179.251 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.05 140.44 51.0 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.659 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 504' ' ' ARG . . . . . 0.447 ' HB2' ' HE1' ' A' ' 511' ' ' MET . 35.4 ptt85 -79.52 134.59 36.5 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.342 0.591 . . . . 0.0 111.435 -178.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt -156.02 160.26 39.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.757 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.492 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 8.3 ptm -103.72 110.23 22.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.941 0.4 . . . . 0.0 111.555 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.543 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.68 110.88 22.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.882 179.011 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 56.0 t30 59.7 40.52 19.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.685 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 509' ' ' ASP . . . . . 0.492 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 0.6 OUTLIER 75.7 12.54 3.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.373 -180.0 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.425 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.18 131.76 56.85 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.619 0.247 . . . . 0.0 111.003 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.765 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -61.67 108.7 1.03 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.057 0.456 . . . . 0.0 110.69 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.588 ' CE1' HG23 ' A' ' 469' ' ' THR . 9.1 m80 -122.6 131.4 53.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.063 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.659 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.1 OUTLIER -109.81 123.75 50.1 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.848 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.616 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.5 OUTLIER -179.23 169.11 1.5 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.22 0.533 . . . . 0.0 112.236 -178.858 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.705 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.4 pt? -119.33 169.23 10.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.44 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.423 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -139.26 106.3 5.45 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.987 0.422 . . . . 0.0 111.264 179.541 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.815 ' HB2' HG22 ' A' ' 464' ' ' THR . 4.4 mm-40 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.769 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 587' ' ' ASP . . . . . 0.648 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 120.75 0.309 . . . . 0.0 111.459 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -53.8 -55.14 29.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.09 0.472 . . . . 0.0 111.367 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 589' ' ' HIS . . . . . 0.4 ' HA ' ' HB3' ' B' ' 592' ' ' TYR . 1.5 p80 -80.15 -21.88 42.62 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.224 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.911 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.7 tp -48.33 -33.79 9.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.128 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 68.4 mt -85.89 -29.65 6.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.86 0.362 . . . . 0.0 110.512 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.55 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -63.7 -40.38 96.65 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.15 179.906 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.811 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -80.16 -18.15 50.51 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.267 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.683 ' N ' HD13 ' B' ' 593' ' ' LEU . 71.0 tt0 -63.06 -30.91 71.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.863 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 9.6 pt-20 -80.63 -48.06 13.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.164 -179.389 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.677 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -52.2 -26.63 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.168 0.508 . . . . 0.0 110.893 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.923 HD22 ' HG ' ' A' ' 497' ' ' LEU . 13.4 tp -69.53 -82.65 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.936 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.684 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 30.8 m . . . . . 0 N--CA 1.436 -1.138 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.319 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.842 HG22 ' CE2' ' A' ' 477' ' ' PHE . 1.4 t . . . . . 0 CA--C 1.519 -0.244 0 CA-C-O 120.926 0.393 . . . . 0.0 110.955 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.579 ' O ' HG23 ' A' ' 459' ' ' VAL . 33.1 p -131.56 169.12 16.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.609 0.718 . . . . 0.0 112.537 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.698 ' HA ' HG23 ' A' ' 496' ' ' ILE . 26.6 mt-10 -69.24 -53.49 19.6 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.591 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.66 -27.87 59.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.158 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -73.98 -32.36 63.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.589 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.773 ' HB ' HD21 ' A' ' 500' ' ' LEU . 10.2 t -76.02 -36.72 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.864 0.364 . . . . 0.0 111.091 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.625 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -54.9 -46.05 74.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.123 179.106 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.441 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.2 OUTLIER -64.25 -26.15 68.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.793 179.486 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.532 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 18.0 m-30 -72.02 -36.31 69.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.141 179.243 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.862 HD11 HD22 ' A' ' 500' ' ' LEU . 1.3 mt -75.33 -59.39 2.77 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.186 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.538 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -46.11 -27.41 0.95 Allowed 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.555 179.827 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -85.77 -52.85 5.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.784 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.451 ' HG3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -167.57 135.4 1.96 Allowed Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.575 -179.756 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.574 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 33.2 Cg_exo -53.74 176.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.014 1.809 . . . . 0.0 113.02 -179.19 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.99 ' HG2' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -164.73 171.76 13.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.878 -177.439 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.66 HG22 ' CD2' ' A' ' 512' ' ' HIS . 1.4 p -112.21 157.95 20.28 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 177.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.608 HG23 HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.17 -39.98 84.18 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.24 -0.584 . . . . 0.0 110.569 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.843 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -65.74 -50.91 63.07 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.765 178.942 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -62.9 -22.21 66.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.418 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.99 HD21 ' HG2' ' A' ' 468' ' ' MET . 10.7 mt -76.65 -46.26 26.56 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.911 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.5 OUTLIER -73.27 -50.7 20.82 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.761 0.315 . . . . 0.0 111.199 -179.169 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.664 ' HD3' HD12 ' A' ' 474' ' ' LEU . 23.8 mmtt -52.11 -25.19 8.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.185 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.632 ' HE2' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -70.47 -43.99 68.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.853 0.358 . . . . 0.0 110.499 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.842 ' CE2' HG22 ' A' ' 454' ' ' VAL . 15.5 m-85 . . . . . 0 CA--C 1.511 -0.555 0 CA-C-O 121.867 0.842 . . . . 0.0 109.874 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 1.066 HD23 HG11 ' A' ' 492' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.448 0 CA-C-O 120.996 0.427 . . . . 0.0 111.366 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.13 161.13 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.589 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 23.4 p -60.18 -25.15 65.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.077 0.465 . . . . 0.0 109.951 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -90.45 -46.3 8.43 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.422 179.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.665 ' O ' HG12 ' A' ' 492' ' ' VAL . 5.3 mt-30 -62.21 -41.95 98.84 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.889 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 88.6 m -50.76 -29.31 11.15 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.547 HG13 HD22 ' A' ' 474' ' ' LEU . 3.2 t -83.93 -41.14 16.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.293 179.264 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.58 -28.21 65.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.321 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 1.066 HG11 HD23 ' A' ' 484' ' ' LEU . 4.4 p -101.58 -7.57 9.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.957 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.786 HD23 ' HB3' ' A' ' 474' ' ' LEU . 3.4 tp -95.11 -35.89 11.72 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.943 0.402 . . . . 0.0 110.784 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.607 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -58.92 -38.99 80.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.175 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -41.6 88.02 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.825 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.698 HG23 ' HA ' ' A' ' 456' ' ' GLU . 12.7 mt -81.05 -30.07 11.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.351 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.923 ' HG ' HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -49.36 -56.93 7.91 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -178.622 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.677 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -61.86 -28.94 69.85 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -177.89 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.522 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 16.7 mmm180 -55.05 -22.16 14.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.059 0.457 . . . . 0.0 110.714 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.862 HD22 HD11 ' A' ' 463' ' ' LEU . 50.0 mt -63.15 -48.01 80.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.291 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.597 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.9 t-20 55.18 57.36 11.04 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.898 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.597 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 58.2 Cg_endo -100.36 -160.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.222 0 C-N-CA 124.083 3.189 . . . . 0.0 111.66 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.47 140.33 51.57 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.705 178.879 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -79.55 135.69 36.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.377 0.608 . . . . 0.0 111.535 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -154.69 147.46 24.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.747 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.44 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 6.9 ptm -90.14 108.77 19.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.011 0.434 . . . . 0.0 111.77 -179.6 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.436 ' N ' ' O ' ' A' ' 510' ' ' LYS . 0.6 OUTLIER -92.7 110.77 23.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.884 178.872 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 59.63 40.39 20.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.932 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 509' ' ' ASP . . . . . 0.44 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 6.6 m-20 77.11 10.31 2.55 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.524 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.446 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.6 tpmt? -116.09 131.83 56.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.594 0.235 . . . . 0.0 110.679 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 6.6 tpt -66.61 108.42 2.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.119 0.485 . . . . 0.0 111.052 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.66 ' CD2' HG22 ' A' ' 469' ' ' THR . 12.1 m170 -122.74 137.9 54.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.225 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.597 ' CE1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -118.54 122.97 43.95 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.698 0.285 . . . . 0.0 110.721 179.652 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.574 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -168.95 169.8 9.42 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.196 0.522 . . . . 0.0 111.993 -179.302 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.769 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.3 pt? -111.01 169.09 9.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.198 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.401 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -135.37 106.65 6.78 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.389 -0.524 . . . . 0.0 111.59 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.538 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.105 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 588' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' B' ' 589' ' ' HIS . 39.0 p-10 -50.75 -51.53 49.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.879 0.371 . . . . 0.0 111.843 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 589' ' ' HIS . . . . . 0.42 ' N ' ' OD1' ' B' ' 588' ' ' ASP . 2.5 p80 -80.52 -21.96 41.36 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.327 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.985 ' CD1' HD21 ' A' ' 474' ' ' LEU . 31.6 tp -54.69 -33.86 61.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.007 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 83.2 mt -85.85 -29.62 6.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.896 0.379 . . . . 0.0 110.818 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.19 -40.72 96.7 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.382 -179.818 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.806 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.91 -18.11 54.41 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.107 0.48 . . . . 0.0 110.211 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.743 ' N ' HD13 ' B' ' 593' ' ' LEU . 79.8 tt0 -62.78 -32.66 73.86 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.001 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 8.0 pt-20 -79.5 -47.43 15.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.355 -179.075 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.692 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.0 pp -51.45 -26.7 6.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 120.965 0.412 . . . . 0.0 111.276 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.853 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.8 tp -69.87 -83.04 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.492 0.663 . . . . 0.0 111.435 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.673 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m . . . . . 0 N--CA 1.437 -1.083 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.527 -178.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.533 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.3 t . . . . . 0 CA--C 1.517 -0.311 0 CA-C-O 121.036 0.446 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.569 ' O ' HG23 ' A' ' 459' ' ' VAL . 28.4 p -132.1 163.0 29.44 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.516 0.674 . . . . 0.0 112.285 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.57 ' HA ' HG23 ' A' ' 496' ' ' ILE . 15.9 mt-10 -59.35 -54.53 45.74 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.126 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -28.25 19.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.777 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -77.65 -35.42 52.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.777 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.839 ' CG1' HD21 ' A' ' 500' ' ' LEU . 6.1 t -76.18 -34.85 26.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.684 0.278 . . . . 0.0 111.743 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.562 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.2 mmm180 -59.82 -37.22 78.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.643 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.3 OUTLIER -68.95 -31.75 70.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.138 179.313 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.478 ' O ' ' O ' ' A' ' 466' ' ' LYS . 14.7 m-30 -62.17 -45.01 95.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.095 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.033 HD11 HD22 ' A' ' 500' ' ' LEU . 0.3 OUTLIER -65.9 -59.23 4.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.09 179.774 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.76 HG22 ' CG ' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -49.24 -25.26 2.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.032 0.444 . . . . 0.0 110.424 179.639 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.581 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 45.5 ttt180 -90.98 -31.19 16.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.134 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.674 ' HE2' ' HD3' ' A' ' 467' ' ' PRO . 0.0 OUTLIER 167.15 167.91 0.11 Allowed Pre-proline 0 CA--C 1.532 0.253 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.592 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.714 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 84.5 Cg_endo -74.43 160.87 41.15 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.283 1.989 . . . . 0.0 114.113 -178.456 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.724 ' SD ' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.56 159.33 44.57 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 114.999 -1.001 . . . . 0.0 111.005 -179.008 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.685 ' O ' HD12 ' A' ' 473' ' ' LEU . 17.4 p -108.45 163.41 13.24 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.514 HG21 ' HA ' ' B' ' 594' ' ' GLU . 0.7 OUTLIER -64.63 -36.76 85.29 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.672 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.872 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -72.97 -50.22 24.61 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.42 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -61.12 -26.2 67.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.474 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.836 HD13 HD11 ' A' ' 497' ' ' LEU . 0.4 OUTLIER -69.1 -46.56 67.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.027 0.441 . . . . 0.0 111.152 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 1.083 HD22 HG22 ' A' ' 490' ' ' VAL . 2.1 pp -84.19 -31.87 24.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.589 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.52 -29.69 2.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.84 0.352 . . . . 0.0 110.922 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.481 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -93.12 -35.17 13.33 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.929 179.625 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.533 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.2 m-85 . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.867 HD21 HG11 ' A' ' 492' ' ' VAL . 6.1 tp . . . . . 0 N--CA 1.449 -0.484 0 CA-C-O 120.967 0.413 . . . . 0.0 110.983 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.37 145.81 0.16 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.888 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 3.1 t -58.29 -22.56 53.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.726 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -91.52 -48.75 6.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.716 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.735 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.0 OUTLIER -63.05 -38.7 92.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.872 179.524 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.413 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 96.7 m -51.69 -30.08 20.64 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.591 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 1.083 HG22 HD22 ' A' ' 474' ' ' LEU . 4.6 t -82.72 -40.07 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.087 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -60.53 -29.99 69.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.057 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.867 HG11 HD21 ' A' ' 484' ' ' LEU . 4.3 p -100.59 -6.98 9.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.94 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.688 ' CD1' HD22 ' A' ' 497' ' ' LEU . 16.7 tp -93.61 -40.17 10.42 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.073 0.463 . . . . 0.0 110.373 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.611 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -53.96 -42.12 68.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.381 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -40.16 95.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.975 -179.328 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.57 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.2 mt -78.52 -41.67 25.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 112.559 0.578 . . . . 0.0 112.559 -178.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.853 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -37.66 -58.73 0.86 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.524 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.692 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.44 -22.98 62.28 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.369 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.479 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 0.8 OUTLIER -63.56 -18.75 64.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 0.0 110.457 179.133 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.033 HD22 HD11 ' A' ' 463' ' ' LEU . 34.0 mt -62.69 -47.78 82.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.434 -179.044 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.647 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 28.0 t-20 55.22 54.52 9.94 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.197 -179.069 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.647 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 61.2 Cg_endo -101.72 -161.0 0.04 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 124.209 3.272 . . . . 0.0 111.712 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.76 139.87 51.62 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.565 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 504' ' ' ARG . . . . . 0.447 ' HB2' ' HE1' ' A' ' 511' ' ' MET . 30.1 ptt180 -79.53 132.45 36.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.451 0.643 . . . . 0.0 111.553 -178.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -156.27 130.07 8.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.841 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.407 ' HE2' ' HB2' ' A' ' 506' ' ' MET . 0.1 OUTLIER -76.47 112.29 12.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.908 0.385 . . . . 0.0 111.535 -179.605 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.445 ' HB ' ' ND1' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.52 122.54 42.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.655 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 508' ' ' ASN . . . . . 0.405 ' ND2' HG22 ' A' ' 507' ' ' ILE . 18.6 p30 48.91 37.56 10.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.436 -179.262 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 509' ' ' ASP . . . . . 0.404 ' CB ' ' O ' ' A' ' 508' ' ' ASN . 12.6 t70 80.12 13.03 0.97 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.563 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.431 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -116.28 131.48 56.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.594 179.715 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.469 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -62.05 108.29 1.02 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.087 0.47 . . . . 0.0 110.635 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.566 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 28.6 m80 -123.26 127.87 49.19 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.861 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.63 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.0 OUTLIER -104.92 123.73 48.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.803 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.714 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -178.33 169.47 1.82 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.407 0.622 . . . . 0.0 112.276 -178.756 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.794 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -122.82 168.96 11.6 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.337 178.56 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.97 106.06 8.4 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.207 0.527 . . . . 0.0 111.178 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.76 ' CG ' HG22 ' A' ' 464' ' ' THR . 2.4 pt-20 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.178 -0.915 . . . . 0.0 111.0 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.261 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -53.96 -55.11 30.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.008 0.432 . . . . 0.0 111.601 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -77.49 -21.91 52.06 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.041 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.918 ' CD1' HD21 ' A' ' 474' ' ' LEU . 26.3 tp -58.47 -37.94 76.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.733 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 64.7 mt -86.01 -29.81 6.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.905 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.571 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.32 -40.83 86.0 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-O 121.063 0.459 . . . . 0.0 110.992 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.905 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -80.14 -18.16 50.55 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.957 179.781 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.797 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.1 OUTLIER -63.41 -32.5 73.95 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.614 179.605 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 7.7 pt-20 -78.93 -46.87 17.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.385 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.727 HD11 ' HB1' ' A' ' 494' ' ' ALA . 1.6 pp -50.76 -26.63 4.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.09 0.471 . . . . 0.0 110.911 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.897 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.2 tp -71.65 -82.58 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.618 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.681 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.439 -1.023 0 CA-C-N 114.59 -1.187 . . . . 0.0 110.66 -177.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.612 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.3 t . . . . . 0 CA--C 1.519 -0.232 0 CA-C-O 120.893 0.378 . . . . 0.0 110.682 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.488 ' O ' HG23 ' A' ' 459' ' ' VAL . 33.4 p -131.67 172.89 11.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.704 0.764 . . . . 0.0 112.489 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.711 ' HA ' HG23 ' A' ' 496' ' ' ILE . 18.2 mt-10 -69.18 -53.26 20.93 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.463 179.237 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -28.46 64.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.955 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.442 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -70.55 -34.34 72.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.569 -179.507 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.802 HG13 HD11 ' A' ' 473' ' ' LEU . 18.6 t -76.15 -37.46 32.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.768 0.318 . . . . 0.0 111.369 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.795 ' O ' HG23 ' A' ' 464' ' ' THR . 1.7 mmm-85 -54.49 -44.57 72.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.073 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.497 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -62.83 -29.25 70.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.446 179.4 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.497 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 10.5 m-30 -68.94 -44.63 72.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.114 0.483 . . . . 0.0 109.909 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.013 HD11 HD22 ' A' ' 500' ' ' LEU . 0.7 OUTLIER -67.31 -59.78 3.13 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.224 -179.858 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.795 HG23 ' O ' ' A' ' 460' ' ' ARG . 17.9 p -47.34 -27.38 1.59 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.009 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.4 mtp85 -88.68 -40.76 13.04 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.015 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.487 ' HD2' ' O ' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -175.96 146.39 0.82 Allowed Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.913 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.673 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 39.9 Cg_endo -65.02 151.76 84.68 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.66 2.24 . . . . 0.0 113.115 -179.234 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.751 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -147.7 163.83 35.46 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.338 0.589 . . . . 0.0 112.072 -179.317 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.625 HG22 ' O ' ' A' ' 511' ' ' MET . 3.0 p -107.62 160.68 15.51 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.177 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.905 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -53.26 -46.65 69.31 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.865 -179.641 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.867 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -58.97 -57.02 14.91 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.03 179.287 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -60.57 -26.73 67.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.759 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.802 HD11 HG13 ' A' ' 459' ' ' VAL . 1.5 tt -77.92 -43.9 28.59 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.02 0.438 . . . . 0.0 111.498 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.918 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.9 pp -84.07 -32.9 24.55 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.251 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.413 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.1 OUTLIER -50.54 -33.4 21.53 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.801 0.334 . . . . 0.0 111.433 -179.428 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -75.21 -42.02 56.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.338 -179.681 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.612 ' CE2' HG22 ' A' ' 454' ' ' VAL . 12.4 m-85 . . . . . 0 N--CA 1.454 -0.249 0 CA-C-O 121.035 0.445 . . . . 0.0 110.997 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.411 ' CD2' HG11 ' A' ' 492' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.45 -0.454 0 CA-C-O 120.98 0.419 . . . . 0.0 111.001 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.22 149.92 0.47 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.561 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 486' ' ' SER . . . . . 0.593 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.7 OUTLIER -58.47 -23.31 57.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.176 178.972 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -86.53 -55.06 4.05 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.613 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -60.0 -40.72 90.19 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.241 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.417 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 97.7 m -50.55 -33.37 21.53 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.762 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 486' ' ' SER . 4.5 t -76.82 -42.68 33.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.873 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -57.19 -25.97 59.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.391 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.526 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 8.0 p -100.57 -14.92 7.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.266 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.854 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.2 OUTLIER -91.36 -32.32 15.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.009 0.433 . . . . 0.0 110.462 179.893 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.781 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -59.3 -39.84 84.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.8 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.526 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.5 OUTLIER -65.88 -41.4 91.61 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.679 -179.59 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.711 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.8 mt -78.42 -32.29 16.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.669 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.897 ' HB3' HD13 ' B' ' 597' ' ' LEU . 1.1 mm? -49.89 -49.85 48.09 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 -178.503 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.686 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -66.49 -29.07 69.09 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.194 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.57 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.4 mmm180 -58.22 -21.69 48.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.992 0.425 . . . . 0.0 110.453 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.013 HD22 HD11 ' A' ' 463' ' ' LEU . 37.9 mt -60.74 -47.45 86.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.858 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.581 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.0 t-20 56.33 58.56 9.04 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.6 -179.058 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.581 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 95.5 Cg_endo -100.91 -158.95 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 124.027 3.151 . . . . 0.0 111.391 -179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.92 139.98 52.48 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.756 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.47 134.24 36.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.381 0.61 . . . . 0.0 111.407 -178.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -156.12 160.16 39.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.717 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.83 109.36 21.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.901 0.381 . . . . 0.0 111.591 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.516 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.67 110.91 22.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.92 179.072 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 59.58 43.21 16.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.697 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 72.93 12.38 5.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.337 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.43 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.7 tpmt? -116.12 132.8 56.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.634 0.254 . . . . 0.0 110.918 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.625 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -64.23 108.8 1.67 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.999 0.428 . . . . 0.0 110.715 179.802 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.516 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 15.9 m80 -122.64 124.87 44.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.034 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.669 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -105.65 123.81 48.54 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.565 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.673 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -178.81 169.18 1.65 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.162 0.506 . . . . 0.0 112.153 -178.52 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.705 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.5 pt? -118.95 169.23 10.06 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.452 179.028 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.402 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -139.78 106.31 5.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.994 0.426 . . . . 0.0 111.33 179.606 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.907 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 587' ' ' ASP . . . . . 0.42 ' O ' ' HB3' ' B' ' 590' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 p30 -58.24 -39.68 79.77 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.26 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -80.03 -21.0 44.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.961 ' CD1' HD21 ' A' ' 474' ' ' LEU . 17.3 tp -48.43 -29.82 4.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.024 0.44 . . . . 0.0 110.624 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 591' ' ' ILE . . . . . 0.484 HG23 ' OE2' ' B' ' 594' ' ' GLU . 72.8 mt -85.58 -29.55 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.623 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.586 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.35 -42.83 99.34 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.433 -179.705 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.849 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.58 -17.71 55.7 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.225 0.536 . . . . 0.0 109.845 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.82 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.4 OUTLIER -63.15 -33.8 76.25 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.671 179.686 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 7.1 pt-20 -78.6 -46.99 18.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.636 -178.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.682 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.5 pp -49.79 -26.68 2.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.101 0.477 . . . . 0.0 111.124 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.899 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.4 tp -72.32 -82.44 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.68 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.711 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.9 m . . . . . 0 N--CA 1.438 -1.036 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.774 -177.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.465 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.5 t . . . . . 0 CA--C 1.517 -0.323 0 CA-C-O 121.04 0.448 . . . . 0.0 110.917 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 32.2 p -131.83 168.07 18.47 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.65 0.738 . . . . 0.0 112.233 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.662 ' HA ' HG23 ' A' ' 496' ' ' ILE . 23.6 mt-10 -62.53 -52.96 61.39 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.315 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 457' ' ' ASP . . . . . 0.418 ' HA ' ' HG2' ' A' ' 460' ' ' ARG . 0.1 OUTLIER -60.83 -28.46 68.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.251 -179.46 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -67.68 -38.14 83.3 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.863 0.363 . . . . 0.0 111.322 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.841 HG13 HD11 ' A' ' 473' ' ' LEU . 21.0 t -72.38 -32.86 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.947 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.543 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -56.61 -49.61 74.44 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 178.636 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -59.01 -25.02 63.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.727 179.543 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.513 ' HH ' ' HZ ' ' A' ' 477' ' ' PHE . 14.7 m-30 -73.17 -46.54 50.16 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.108 0.48 . . . . 0.0 109.734 178.679 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.875 HD11 HD22 ' A' ' 500' ' ' LEU . 0.6 OUTLIER -65.72 -57.91 6.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.233 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.855 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.26 -27.76 2.67 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.087 0.47 . . . . 0.0 110.506 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 465' ' ' ARG . . . . . 0.578 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 31.0 ttt85 -87.98 -32.64 18.74 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.806 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.578 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER 169.29 153.15 0.15 Allowed Pre-proline 0 CA--C 1.53 0.21 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.746 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.675 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 40.3 Cg_endo -64.96 165.45 21.42 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.64 2.227 . . . . 0.0 113.595 -179.192 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.712 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -159.46 152.78 22.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.407 -179.125 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.692 HG22 ' O ' ' A' ' 511' ' ' MET . 12.3 p -96.82 155.87 16.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.242 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.502 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.0 OUTLIER -51.02 -45.86 61.4 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.888 -179.662 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.839 ' CG ' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -59.37 -53.73 54.87 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.033 178.989 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -61.43 -33.41 73.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.625 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.841 HD11 HG13 ' A' ' 459' ' ' VAL . 0.9 OUTLIER -71.01 -41.39 70.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.981 0.42 . . . . 0.0 111.5 -179.583 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.967 ' HB3' HD23 ' A' ' 493' ' ' LEU . 2.4 pp -84.39 -34.77 23.5 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.997 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.429 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -48.96 -31.81 8.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.716 0.293 . . . . 0.0 111.413 -179.385 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.495 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -81.14 -33.84 32.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.238 -179.871 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.513 ' HZ ' ' HH ' ' A' ' 462' ' ' TYR . 15.1 m-85 . . . . . 0 N--CA 1.455 -0.217 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 19.2 tp . . . . . 0 N--CA 1.448 -0.569 0 CA-C-O 120.973 0.416 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.86 143.87 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.789 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 486' ' ' SER . . . . . 0.646 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.3 OUTLIER -59.88 -22.07 61.85 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.97 0.414 . . . . 0.0 110.002 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -82.69 -52.83 6.42 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.778 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -63.5 -38.79 92.47 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.978 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.418 HG23 ' HB3' ' A' ' 477' ' ' PHE . 93.0 m -51.45 -30.38 19.41 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.646 HG23 ' O ' ' A' ' 486' ' ' SER . 4.2 t -79.09 -43.15 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.032 179.102 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -57.12 -25.93 59.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.602 179.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.408 ' O ' HG22 ' A' ' 492' ' ' VAL . 7.6 p -100.85 -13.83 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.307 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.967 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.5 OUTLIER -89.33 -37.07 15.17 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.086 0.469 . . . . 0.0 110.452 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.758 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -55.32 -40.22 70.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.386 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -41.27 97.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.156 -179.171 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.662 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.4 mt -75.08 -45.84 41.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.899 ' HB3' HD13 ' B' ' 597' ' ' LEU . 3.2 mm? -36.3 -59.79 0.61 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.347 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.682 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.81 -30.16 68.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.774 0.321 . . . . 0.0 111.809 -178.85 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.408 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 1.2 tpt180 -60.29 -24.34 64.88 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.957 0.408 . . . . 0.0 110.75 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.875 HD22 HD11 ' A' ' 463' ' ' LEU . 52.2 mt -61.07 -47.22 87.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.69 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.574 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 50.2 t-20 58.45 59.12 6.1 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.962 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.574 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 71.5 Cg_endo -101.56 -160.1 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 124.045 3.164 . . . . 0.0 111.441 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.82 139.4 53.2 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.817 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 504' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 505' ' ' LYS . 7.9 ptt85 -79.69 131.54 35.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.482 0.658 . . . . 0.0 111.758 -178.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' A' ' 504' ' ' ARG . 0.1 OUTLIER -148.26 160.13 43.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.406 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.515 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 7.2 ptm -105.03 108.84 20.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.92 0.391 . . . . 0.0 111.295 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.557 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.59 110.88 22.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.011 179.274 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 59.7 41.65 18.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.793 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 509' ' ' ASP . . . . . 0.515 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 1.9 t0 73.95 13.85 4.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.209 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.448 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.11 132.01 56.78 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.926 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.692 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.15 108.7 1.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.095 0.474 . . . . 0.0 110.658 179.759 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.612 ' CE1' HG23 ' A' ' 469' ' ' THR . 19.7 m80 -122.8 127.12 48.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.107 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.627 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.54 123.91 48.81 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.646 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.675 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -177.52 169.39 2.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.254 0.55 . . . . 0.0 112.441 -178.66 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.712 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.4 pt? -117.4 169.18 9.71 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.213 -0.903 . . . . 0.0 108.942 178.728 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.429 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -138.0 106.45 5.82 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.479 179.787 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.855 ' HB2' HG22 ' A' ' 464' ' ' THR . 8.5 mm-40 . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.761 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 588' ' ' ASP . . . . . 0.429 ' OD1' ' N ' ' B' ' 589' ' ' HIS . 14.5 p-10 -50.7 -50.26 55.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.883 0.373 . . . . 0.0 111.874 -178.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 589' ' ' HIS . . . . . 0.429 ' N ' ' OD1' ' B' ' 588' ' ' ASP . 1.0 OUTLIER -80.53 -23.72 39.83 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.353 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 0.872 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.9 tp -55.15 -35.76 65.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.971 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 67.7 mt -85.88 -29.72 6.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.901 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.539 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.79 -42.62 81.36 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.474 -179.686 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.846 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -75.33 -22.16 57.84 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.2 0.524 . . . . 0.0 109.925 179.559 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.646 ' N ' HD13 ' B' ' 593' ' ' LEU . 72.4 tt0 -63.32 -30.87 71.93 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.888 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.425 ' HG3' ' N ' ' B' ' 596' ' ' ILE . 0.0 OUTLIER -76.89 -36.88 56.38 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.362 -179.038 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.96 HD11 ' HB1' ' A' ' 494' ' ' ALA . 4.0 pt -61.4 -26.54 39.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.114 0.483 . . . . 0.0 111.183 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.782 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.6 tp -72.83 -81.86 0.05 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.03 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.683 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.2 m . . . . . 0 N--CA 1.438 -1.05 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.724 -177.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.52 HG22 ' CE2' ' A' ' 477' ' ' PHE . 3.4 t . . . . . 0 CA--C 1.516 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.547 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.4 p -131.84 167.32 19.77 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.665 0.745 . . . . 0.0 112.449 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.708 ' HA ' HG23 ' A' ' 496' ' ' ILE . 19.2 mt-10 -63.04 -53.47 53.25 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 114.561 -1.199 . . . . 0.0 110.505 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.37 -28.28 65.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.88 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.438 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -72.63 -34.31 67.22 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.779 -179.462 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.705 ' CG1' HD21 ' A' ' 500' ' ' LEU . 18.3 t -75.97 -36.77 32.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.476 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.522 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -54.51 -45.46 73.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.932 0.396 . . . . 0.0 110.131 179.135 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.498 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -62.16 -29.31 70.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.891 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.681 ' HD2' HD21 ' A' ' 473' ' ' LEU . 10.7 m-30 -68.3 -44.13 76.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.072 0.463 . . . . 0.0 110.178 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 1.03 HD11 HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -67.24 -59.25 3.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.305 -179.657 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.674 HG22 ' CG ' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -49.58 -26.25 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.99 0.424 . . . . 0.0 110.572 179.894 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -90.07 -46.22 8.63 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.009 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.538 ' HE2' ' HG2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -171.78 131.02 0.73 Allowed Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.916 -179.584 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.618 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 10.7 Cg_endo -52.51 163.25 1.86 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.366 2.044 . . . . 0.0 112.405 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.633 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -157.39 159.12 37.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.245 0.545 . . . . 0.0 112.102 -178.609 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.714 HG22 ' O ' ' A' ' 511' ' ' MET . 5.1 p -102.54 155.59 18.17 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.161 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.526 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -51.77 -43.98 63.2 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.859 -179.485 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.844 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -60.54 -58.81 6.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.284 0.564 . . . . 0.0 109.735 178.855 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.16 -20.28 39.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.498 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.702 HD11 HG13 ' A' ' 459' ' ' VAL . 0.5 OUTLIER -87.57 -40.76 13.98 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.887 0.375 . . . . 0.0 111.702 -179.575 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.976 HD22 HG13 ' A' ' 490' ' ' VAL . 1.3 pp -84.03 -49.73 8.65 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.504 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.59 ' HD3' HD12 ' A' ' 474' ' ' LEU . 18.3 mmtp -48.72 -25.34 1.76 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.76 0.314 . . . . 0.0 111.475 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.534 ' HE2' HD23 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -81.55 -43.59 18.52 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.722 179.818 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.52 ' CE2' HG22 ' A' ' 454' ' ' VAL . 8.3 m-85 . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 121.092 0.473 . . . . 0.0 110.938 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.886 ' CD2' HG11 ' A' ' 492' ' ' VAL . 1.3 tp . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.997 0.427 . . . . 0.0 111.503 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.14 154.95 0.33 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.401 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 5.1 p -61.25 -26.3 67.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.515 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -90.73 -42.34 10.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.611 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.603 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.9 mt-30 -65.73 -40.99 92.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.092 179.43 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.464 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 89.5 m -50.28 -29.42 9.63 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.64 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 0.976 HG13 HD22 ' A' ' 474' ' ' LEU . 10.1 t -82.66 -40.85 17.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.004 179.069 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -58.34 -28.2 64.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.389 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 0.886 HG11 ' CD2' ' A' ' 484' ' ' LEU . 4.0 p -102.15 -8.89 9.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.384 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.931 HD23 ' HB3' ' A' ' 474' ' ' LEU . 2.3 tp -93.31 -40.59 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.043 0.449 . . . . 0.0 110.908 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.96 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -53.26 -45.23 68.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.279 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.422 ' O ' ' HD3' ' A' ' 499' ' ' ARG . 0.0 OUTLIER -58.84 -35.99 73.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.001 -179.447 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.708 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.6 mt -81.94 -32.25 11.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.743 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.782 ' HB3' HD13 ' B' ' 597' ' ' LEU . 3.5 mm? -50.98 -48.37 61.2 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.421 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.817 ' NZ ' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -62.02 -32.44 72.93 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -178.72 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.554 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 0.9 OUTLIER -57.74 -23.44 52.06 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.954 0.407 . . . . 0.0 110.526 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 1.03 HD22 HD11 ' A' ' 463' ' ' LEU . 50.8 mt -59.92 -47.36 86.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.698 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.592 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.0 t-20 55.91 57.96 9.79 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.44 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.592 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 87.9 Cg_endo -101.38 -160.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 123.879 3.052 . . . . 0.0 111.485 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.61 141.15 48.87 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.625 178.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -79.42 133.66 36.55 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.396 0.617 . . . . 0.0 111.368 -178.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -156.15 160.13 39.63 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.842 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.7 OUTLIER -105.16 110.27 22.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.902 0.382 . . . . 0.0 111.509 -179.813 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.551 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.65 110.92 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.781 178.89 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.5 44.27 15.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.74 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 71.72 13.04 6.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.318 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.442 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.7 tpmt? -116.17 132.03 56.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.644 -0.253 . . . . 0.0 110.886 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 511' ' ' MET . . . . . 0.714 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.3 108.66 1.35 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.993 0.425 . . . . 0.0 110.589 179.721 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.569 ' CE1' HG23 ' A' ' 469' ' ' THR . 16.5 m80 -122.68 125.29 45.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.248 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.61 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -105.22 123.55 48.02 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.516 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.652 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.4 OUTLIER -177.98 169.38 1.97 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.151 0.501 . . . . 0.0 112.21 -178.896 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.723 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.3 pt? -116.57 169.16 9.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.286 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.45 106.43 6.65 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.026 0.441 . . . . 0.0 111.35 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.674 ' CG ' HG22 ' A' ' 464' ' ' THR . 4.7 pt-20 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.121 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 120.787 0.327 . . . . 0.0 111.532 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -51.02 -55.0 19.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.069 0.461 . . . . 0.0 111.611 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -79.57 -21.82 44.59 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.205 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 590' ' ' LEU . . . . . 1.0 HD11 ' HA ' ' A' ' 471' ' ' LYS . 37.9 tp -52.68 -29.56 27.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.937 0.399 . . . . 0.0 111.05 -179.936 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 97.3 mt -85.41 -29.5 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 CA-C-O 120.975 0.417 . . . . 0.0 110.786 -179.892 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 592' ' ' TYR . . . . . 0.6 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.91 -45.61 85.16 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.849 -179.507 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 593' ' ' LEU . . . . . 0.788 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -70.02 -18.22 63.3 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.972 0.415 . . . . 0.0 110.373 -179.704 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 594' ' ' GLU . . . . . 0.617 ' N ' HD13 ' B' ' 593' ' ' LEU . 62.5 tt0 -62.8 -30.79 71.74 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 120.853 0.358 . . . . 0.0 110.913 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 595' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' B' ' 592' ' ' TYR . 0.3 OUTLIER -80.19 -46.2 16.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.038 -179.343 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 596' ' ' ILE . . . . . 0.63 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -54.91 -26.54 17.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.944 0.402 . . . . 0.0 111.147 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 597' ' ' LEU . . . . . 0.942 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.8 tp -69.17 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.436 0.636 . . . . 0.0 111.833 179.996 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 598' ' ' VAL . . . . . 0.67 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.5 m . . . . . 0 N--CA 1.437 -1.096 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.593 -177.8 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.816 HG22 ' CD2' ' A' ' 477' ' ' PHE . 62.6 t . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 120.778 0.323 . . . . 0.0 110.575 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 455' ' ' THR . . . . . 0.44 ' O ' HG23 ' A' ' 459' ' ' VAL . 16.9 p -131.68 158.29 41.49 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.552 0.691 . . . . 0.0 112.483 -179.336 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 456' ' ' GLU . . . . . 0.745 ' HA ' HG23 ' A' ' 496' ' ' ILE . 17.1 mt-10 -50.19 -52.46 35.46 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.655 -1.157 . . . . 0.0 111.171 179.425 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.97 -30.75 71.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.376 -179.196 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 458' ' ' ALA . . . . . 0.454 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -70.52 -56.8 5.7 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.765 0.317 . . . . 0.0 111.461 -179.523 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.738 ' HB ' HD21 ' A' ' 500' ' ' LEU . 21.0 t -48.84 -26.47 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.711 0.291 . . . . 0.0 111.221 -179.574 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 460' ' ' ARG . . . . . 0.517 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.7 OUTLIER -61.73 -49.78 75.06 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.547 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 461' ' ' ARG . . . . . 0.483 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -57.94 -30.75 66.22 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.402 179.351 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 462' ' ' TYR . . . . . 0.495 ' CE2' ' CE2' ' A' ' 477' ' ' PHE . 8.5 m-30 -64.54 -42.58 95.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.189 0.518 . . . . 0.0 109.739 178.867 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 463' ' ' LEU . . . . . 0.83 HD11 HD22 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -71.84 -57.89 3.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.291 -179.9 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 464' ' ' THR . . . . . 0.586 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.07 -26.44 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.812 179.993 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -91.65 -50.68 5.63 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.116 179.785 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 466' ' ' LYS . . . . . 0.443 ' CE ' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -168.18 132.99 1.47 Allowed Pre-proline 0 N--CA 1.452 -0.352 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.054 -179.774 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 467' ' ' PRO . . . . . 0.511 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 37.1 Cg_exo -57.38 146.71 81.63 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.374 2.049 . . . . 0.0 113.116 -179.606 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 468' ' ' MET . . . . . 0.853 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -128.97 177.14 7.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.968 -179.571 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 469' ' ' THR . . . . . 0.725 HG22 ' CD2' ' A' ' 512' ' ' HIS . 1.4 p -115.06 157.16 23.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.919 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 470' ' ' THR . . . . . 0.537 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.6 OUTLIER -54.56 -39.56 67.86 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 120.159 -0.617 . . . . 0.0 110.664 -179.602 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 1.0 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -68.97 -60.39 2.4 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.253 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 472' ' ' ASP . . . . . 0.41 ' HB3' ' H ' ' A' ' 469' ' ' THR . 9.6 t70 -52.96 -24.94 10.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.192 179.893 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 473' ' ' LEU . . . . . 0.853 HD12 ' SD ' ' A' ' 468' ' ' MET . 0.7 OUTLIER -69.98 -40.1 75.56 Favored 'General case' 0 CA--C 1.523 -0.069 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.526 -179.438 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 1.039 HD22 HG22 ' A' ' 490' ' ' VAL . 0.9 OUTLIER -84.78 -25.69 28.04 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -179.499 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 475' ' ' LYS . . . . . 0.771 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 68.6 mmtt -57.68 -44.49 85.82 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -178.828 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 476' ' ' LYS . . . . . 0.775 ' HZ1' ' HA ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -74.39 -43.48 56.21 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.596 179.927 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 477' ' ' PHE . . . . . 0.816 ' CD2' HG22 ' A' ' 454' ' ' VAL . 5.1 m-85 . . . . . 0 CA--C 1.511 -0.521 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.062 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 1.041 HD23 HG11 ' A' ' 492' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.451 -0.396 0 CA-C-O 120.701 0.286 . . . . 0.0 111.098 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -39.35 153.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.969 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 486' ' ' SER . . . . . 0.419 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.7 OUTLIER -60.99 -26.15 67.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.261 179.256 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -88.73 -45.95 9.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.382 179.537 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 488' ' ' GLN . . . . . 0.764 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.5 mt-30 -63.48 -41.08 98.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.921 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 489' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 86.0 m -50.28 -30.51 12.03 Favored 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.637 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 490' ' ' VAL . . . . . 1.039 HG22 HD22 ' A' ' 474' ' ' LEU . 7.0 t -83.02 -40.43 16.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.001 179.034 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 491' ' ' ASN . . . . . 0.427 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 5.2 t30 -60.98 -30.87 70.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.938 178.928 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 492' ' ' VAL . . . . . 1.041 HG11 HD23 ' A' ' 484' ' ' LEU . 5.4 p -98.46 -6.85 9.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.887 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.761 HD23 HD23 ' A' ' 474' ' ' LEU . 19.8 tp -95.27 -42.01 8.76 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.994 0.426 . . . . 0.0 110.61 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 494' ' ' ALA . . . . . 0.545 ' HB2' ' HB2' ' B' ' 593' ' ' LEU . . . -54.45 -33.8 60.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.507 -179.921 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -42.79 80.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.125 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 496' ' ' ILE . . . . . 0.745 HG23 ' HA ' ' A' ' 456' ' ' GLU . 12.9 mt -76.08 -46.89 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 112.368 0.506 . . . . 0.0 112.368 -179.06 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 497' ' ' LEU . . . . . 0.942 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -32.85 -64.33 0.19 Allowed 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -178.483 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 498' ' ' LYS . . . . . 0.63 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -61.47 -31.64 71.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.907 0.384 . . . . 0.0 111.575 -178.956 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 499' ' ' ARG . . . . . 0.427 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 2.4 tpt180 -57.59 -23.42 50.77 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.961 179.79 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.83 HD22 HD11 ' A' ' 463' ' ' LEU . 53.1 mt -62.37 -47.5 83.91 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.819 -179.366 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.591 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 50.9 t-20 56.5 58.31 8.83 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.787 -179.349 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 502' ' ' PRO . . . . . 0.591 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 65.2 Cg_endo -101.2 -158.97 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.338 0 C-N-CA 124.097 3.198 . . . . 0.0 111.536 -179.505 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.15 141.91 47.99 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.76 178.881 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.57 135.49 36.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.282 0.563 . . . . 0.0 111.44 -179.026 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -155.26 157.44 37.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.809 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 506' ' ' MET . . . . . 0.47 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 7.4 ptm -105.13 108.93 20.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.994 0.426 . . . . 0.0 111.598 -179.728 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 507' ' ' ILE . . . . . 0.43 HG12 ' HB2' ' A' ' 512' ' ' HIS . 1.2 mm -90.94 110.77 22.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.082 179.225 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.7 t30 59.03 40.35 22.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.764 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 509' ' ' ASP . . . . . 0.47 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 2.7 t70 76.62 12.12 2.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.359 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.447 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.6 tpmt? -116.17 130.65 56.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.765 0.317 . . . . 0.0 110.925 179.696 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 45.3 mmm -65.7 108.92 2.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.983 0.421 . . . . 0.0 111.023 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 512' ' ' HIS . . . . . 0.725 ' CD2' HG22 ' A' ' 469' ' ' THR . 15.1 m170 -122.15 135.35 54.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.289 179.512 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 513' ' ' PHE . . . . . 0.704 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -110.55 123.44 49.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.664 0.269 . . . . 0.0 111.08 -179.896 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 514' ' ' SER . . . . . 0.716 ' OG ' HD22 ' A' ' 463' ' ' LEU . 2.1 m -174.51 169.57 3.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.475 0.655 . . . . 0.0 112.563 -179.691 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 515' ' ' LEU . . . . . 0.779 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.1 pt? -114.35 169.04 9.33 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.551 178.599 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 516' ' ' LYS . . . . . 0.414 ' HD2' ' H ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -132.42 106.54 7.94 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.507 179.849 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.586 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.215 -0.897 . . . . 0.0 111.076 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.851 0.358 . . . . 5.8700000000000001 111.156 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -61.44 90.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 3.9199999999999999 110.914 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.578 HG23 ' HG2' ' B' ' 586' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -90.06 49.63 1.74 Allowed 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.007 0.432 . . . . 2.46 110.712 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.578 ' HG2' HG23 ' B' ' 584' ' ' TPO . 16.4 pt-20 -86.19 -36.79 19.27 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.966 -0.561 . . . . 2.2999999999999998 110.764 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.13 -22.64 31.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.681 -0.69 . . . . 2.3199999999999998 111.605 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -51.01 -55.06 19.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.993 0.425 . . . . 1.8899999999999999 111.626 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.559 ' CE1' ' O ' ' B' ' 586' ' ' GLU . 1.7 p80 -79.07 -21.85 46.17 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.749 -0.66 . . . . 0.54000000000000004 111.183 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.931 ' CD1' HD21 ' A' ' 474' ' ' LEU . 28.2 tp -56.44 -33.37 65.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 0.40999999999999998 110.811 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 591' ' ' ILE . . . . . 0.422 HG23 ' OE2' ' B' ' 594' ' ' GLU . 70.1 mt -85.71 -29.71 6.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.267 -0.424 . . . . 0.68999999999999995 110.804 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.571 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.74 -44.32 86.34 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.142 -0.481 . . . . 1.54 111.446 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.789 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -75.22 -17.94 60.23 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.128 0.489 . . . . 0.32000000000000001 110.032 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.644 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.8 OUTLIER -63.17 -30.78 71.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.005 -0.543 . . . . 1.77 110.853 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.549 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 3.7 pt-20 -82.87 -43.92 16.02 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.608 0.596 . . . . 1.8500000000000001 112.608 -178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.684 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.6 pp -51.07 -26.61 4.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.059 0.456 . . . . 0.55000000000000004 111.231 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.872 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.2 tp -71.32 -82.7 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.527 0.68 . . . . 0.35999999999999999 111.733 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.698 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -141.85 30.4 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 CA-C-N 114.565 -1.198 . . . . 0.44 110.642 -177.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.549 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 28.7 mtp180 -140.41 40.79 1.9 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.545 -0.752 . . . . 2.04 111.205 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 31.3 m . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.247 -0.883 . . . . 1.8 111.111 179.949 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.886 0.374 . . . . 4.5700000000000003 111.159 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.777 ' O ' HG22 ' A' ' 482' ' ' THR . 8.3 p -61.99 144.1 14.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 1.8899999999999999 111.051 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -118.77 138.17 52.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.326 -0.397 . . . . 1.9199999999999999 110.988 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.592 HG22 ' CE2' ' A' ' 477' ' ' PHE . 14.2 t -71.04 110.57 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-N 116.163 -0.471 . . . . 0.58999999999999997 110.78 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.479 ' O ' HG23 ' A' ' 459' ' ' VAL . 28.7 p -131.71 165.34 23.95 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.613 0.72 . . . . 0.38 112.424 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.682 ' HA ' HG23 ' A' ' 496' ' ' ILE . 18.2 mt-10 -60.16 -53.23 60.22 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 114.557 -1.201 . . . . 1.25 110.566 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.32 -28.89 68.49 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.261 -0.881 . . . . 1.29 112.162 -179.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.492 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -71.3 -37.68 71.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.453 -0.34 . . . . 0.38 111.734 -179.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.776 HG13 HD11 ' A' ' 473' ' ' LEU . 21.9 t -72.52 -32.32 41.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.842 -0.343 . . . . 0.28000000000000003 111.541 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.522 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -58.12 -39.56 79.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.391 -0.368 . . . . 2.2599999999999998 110.429 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -67.12 -29.59 69.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 2.54 110.478 179.816 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 5.0 m-30 -69.27 -39.74 78.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 1.27 110.242 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.946 HD11 HD22 ' A' ' 500' ' ' LEU . 2.0 mt -69.89 -63.67 1.03 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.706 -0.679 . . . . 0.39000000000000001 111.733 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.794 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.62 -26.31 1.45 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 0.54000000000000004 110.929 -179.659 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -88.13 -46.81 8.97 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.896 -0.593 . . . . 3.27 111.221 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.8 OUTLIER -170.06 133.94 1.13 Allowed Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.573 -0.285 . . . . 3.9700000000000002 110.891 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.646 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 13.9 Cg_endo -54.83 156.22 15.81 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.444 2.096 . . . . 0.56999999999999995 112.612 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.731 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.47 163.02 39.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.317 0.58 . . . . 0.92000000000000004 111.899 -179.111 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.684 HG22 ' O ' ' A' ' 511' ' ' MET . 4.3 p -106.11 158.92 16.47 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.819 -1.178 . . . . 0.60999999999999999 107.819 177.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.506 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.4 OUTLIER -53.49 -46.62 70.08 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.291 -0.564 . . . . 0.62 110.95 -179.658 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.824 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -59.53 -52.02 67.37 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.885 -0.598 . . . . 1.3200000000000001 110.267 179.171 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -63.61 -32.05 73.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.775 -0.648 . . . . 1.1399999999999999 111.563 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.776 HD11 HG13 ' A' ' 459' ' ' VAL . 0.9 OUTLIER -71.55 -39.39 70.71 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.998 0.428 . . . . 0.95999999999999996 111.354 -179.657 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 1.002 ' HB3' HD23 ' A' ' 493' ' ' LEU . 1.4 pp -83.59 -43.43 15.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.953 -0.567 . . . . 0.55000000000000004 111.548 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.29 -33.98 44.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.5 -0.318 . . . . 2.5299999999999998 111.314 -179.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.458 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -69.52 -39.67 77.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.384 -0.371 . . . . 2.02 111.249 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.592 ' CE2' HG22 ' A' ' 454' ' ' VAL . 15.2 m-85 -66.13 -66.73 0.51 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.493 0.663 . . . . 1.25 110.102 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 51.1 174.7 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.733 -1.121 . . . . 2.54 111.599 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 8.1 m -75.11 0.37 16.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.955 -0.566 . . . . 3.0800000000000001 111.488 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -45.03 -39.49 5.73 Favored 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 111.942 0.349 . . . . 5.1399999999999997 111.942 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt -139.24 -47.09 0.47 Allowed 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.871 0.322 . . . . 3.21 111.871 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.777 HG22 ' O ' ' A' ' 452' ' ' VAL . 12.4 p -53.54 -16.11 1.39 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.61 -0.268 . . . . 0.89000000000000001 111.263 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 62.14 19.54 59.44 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.377 -0.916 . . . . 0.76000000000000001 111.224 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.839 ' CD2' HG11 ' A' ' 492' ' ' VAL . 3.4 mp -104.39 123.71 47.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 120.94 0.4 . . . . 0.97999999999999998 111.226 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.55 157.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.748 -0.66 . . . . 0.66000000000000003 111.688 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.4 -24.35 67.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 1.5700000000000001 110.154 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -90.78 -45.17 8.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.779 -0.646 . . . . 1.53 110.544 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.622 ' O ' HG12 ' A' ' 492' ' ' VAL . 4.2 mt-30 -63.38 -42.78 98.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.58 -0.736 . . . . 1.1399999999999999 110.052 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.432 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 93.4 m -50.19 -28.59 7.76 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.086 0.469 . . . . 0.40999999999999998 109.747 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.608 HG13 HD22 ' A' ' 474' ' ' LEU . 5.1 t -84.73 -41.27 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.562 -0.745 . . . . 0.34999999999999998 109.982 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 491' ' ' ASN . . . . . 0.409 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 3.3 t30 -57.89 -26.13 61.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.265 -0.88 . . . . 0.40999999999999998 110.374 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.839 HG11 ' CD2' ' A' ' 484' ' ' LEU . 3.6 p -101.96 -14.41 8.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.871 -0.604 . . . . 0.31 111.103 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 1.002 HD23 ' HB3' ' A' ' 474' ' ' LEU . 1.4 tp -88.83 -35.98 16.28 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.059 0.456 . . . . 0.98999999999999999 110.585 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.626 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -56.08 -41.97 75.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.556 . . . . 0.28999999999999998 111.305 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.404 ' O ' ' CD ' ' A' ' 498' ' ' LYS . 0.0 OUTLIER -64.21 -38.59 91.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.864 -0.607 . . . . 0.82999999999999996 112.259 -179.212 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.682 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.7 mt -79.84 -30.45 13.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 112.922 0.712 . . . . 0.31 112.922 -178.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.872 ' HB3' HD13 ' B' ' 597' ' ' LEU . 1.1 mm? -49.93 -54.12 21.81 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.048 0.388 . . . . 0.56999999999999995 112.048 -178.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.684 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.98 -29.97 68.8 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.504 0.557 . . . . 0.79000000000000004 112.504 -178.336 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.578 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.7 mmm180 -60.48 -22.81 63.93 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.998 0.428 . . . . 2.4100000000000001 110.475 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.946 HD22 HD11 ' A' ' 463' ' ' LEU . 77.0 mt -61.15 -47.56 85.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.779 -0.646 . . . . 0.34000000000000002 111.841 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.616 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.5 t-20 55.89 56.3 9.78 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.028 -0.533 . . . . 0.60999999999999999 110.051 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.616 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 49.2 Cg_endo -99.55 -160.35 0.04 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 123.965 3.11 . . . . 0.26000000000000001 111.518 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.81 140.83 49.31 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 116.042 -0.526 . . . . 1.1699999999999999 109.769 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.57 134.46 36.47 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.384 0.611 . . . . 2.5 111.463 -179.004 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -156.11 160.14 39.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.105 -0.952 . . . . 0.78000000000000003 109.727 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.415 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.7 OUTLIER -105.04 110.09 22.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.875 0.369 . . . . 0.62 111.643 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.535 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.74 110.9 22.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.38 109.872 179.04 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 32.6 t30 59.12 44.15 16.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.323 -0.398 . . . . 1.3999999999999999 110.829 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 72.02 13.08 5.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.121 -0.49 . . . . 1.6599999999999999 111.414 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.429 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.11 132.95 56.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.616 -0.266 . . . . 1.25 110.885 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.684 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.98 108.67 1.56 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.028 0.442 . . . . 1.1299999999999999 110.747 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.535 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 16.1 m80 -122.75 124.92 44.47 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 1.55 111.026 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.575 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.1 OUTLIER -106.08 123.54 48.16 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.765 -0.457 . . . . 1.27 109.765 178.676 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.67 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.2 OUTLIER 179.6 169.33 1.12 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.163 0.506 . . . . 0.54000000000000004 111.936 -178.907 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.582 ' CD2' ' HB2' ' A' ' 463' ' ' LEU . 0.4 OUTLIER -110.83 169.52 8.7 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.541 -0.754 . . . . 1.52 110.249 179.0 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.31 105.39 4.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.172 0.51 . . . . 1.1799999999999999 110.867 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.794 ' HG2' HG22 ' A' ' 464' ' ' THR . 4.5 pt-20 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.244 -0.884 . . . . 3.3300000000000001 110.993 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.759 0.314 . . . . 0.0 111.149 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -64.97 79.69 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.898 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.554 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -89.98 49.57 1.73 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.981 0.42 . . . . 0.0 110.789 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.531 ' HA ' ' CE1' ' B' ' 589' ' ' HIS . 1.0 OUTLIER -86.11 -38.31 17.9 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.839 179.52 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 587' ' ' ASP . . . . . 0.636 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.4 OUTLIER -84.13 -22.75 30.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.578 -179.419 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -53.3 -55.02 28.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.021 0.438 . . . . 0.0 111.546 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.531 ' CE1' ' HA ' ' B' ' 586' ' ' GLU . 1.5 p80 -79.83 -21.77 43.81 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.254 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.903 HD11 ' HA ' ' A' ' 471' ' ' LYS . 30.0 tp -50.86 -35.43 32.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.184 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 75.3 mt -85.89 -29.42 6.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.898 0.38 . . . . 0.0 110.908 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.535 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.21 -45.23 95.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.294 -179.793 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.794 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.6 -18.53 54.42 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.958 0.409 . . . . 0.0 110.35 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.65 ' N ' HD13 ' B' ' 593' ' ' LEU . 69.1 tt0 -63.19 -30.97 72.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.962 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.509 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 6.8 pt-20 -82.43 -42.59 18.36 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 1.002 HD12 ' HE3' ' A' ' 498' ' ' LYS . 1.0 OUTLIER -52.39 -26.79 9.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.224 0.535 . . . . 0.0 111.504 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' A' ' 497' ' ' LEU . 14.3 tp -74.62 -81.07 0.07 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.426 -0.807 . . . . 0.0 112.492 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.678 HG13 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -140.37 29.7 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.105 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.617 -177.481 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.509 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 11.9 mtp-105 -142.22 38.94 1.58 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.274 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 23.7 m . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.131 -179.993 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.794 0.33 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.562 ' O ' HG22 ' A' ' 482' ' ' THR . 12.1 t -61.1 161.04 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.063 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.485 ' N ' HG12 ' A' ' 452' ' ' VAL . 0.0 OUTLIER -120.9 134.06 55.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.794 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.532 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.7 t -78.99 112.01 16.53 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.025 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 31.4 p -131.91 173.32 11.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.663 0.744 . . . . 0.0 112.605 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.761 ' HA ' HG23 ' A' ' 496' ' ' ILE . 13.3 mt-10 -69.03 -52.53 27.67 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.574 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -27.82 68.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.175 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 458' ' ' ALA . . . . . . . . . . . . . . . -65.16 -58.07 6.95 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.974 0.416 . . . . 0.0 111.174 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.775 HG11 HD11 ' A' ' 500' ' ' LEU . 21.7 t -52.29 -25.57 7.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.621 -179.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.2 mmm-85 -62.95 -41.8 99.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.927 0.394 . . . . 0.0 110.468 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 461' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -23.92 67.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.597 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.521 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 14.7 m-30 -76.04 -44.05 41.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.775 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.68 HD11 HD22 ' A' ' 500' ' ' LEU . 1.1 mt -65.98 -59.67 3.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.748 0.309 . . . . 0.0 111.328 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.513 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -50.0 -26.21 4.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.039 0.447 . . . . 0.0 110.358 179.647 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -88.8 -42.46 11.89 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.724 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.519 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -172.54 161.62 4.07 Favored Pre-proline 0 CA--C 1.531 0.231 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.326 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.643 ' HB2' ' CD2' ' A' ' 512' ' ' HIS . 69.0 Cg_endo -73.3 173.03 14.43 Favored 'Trans proline' 0 N--CA 1.464 -0.252 0 C-N-CA 121.857 1.705 . . . . 0.0 112.91 -179.301 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.962 ' HG3' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -166.81 159.77 13.98 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-O 121.703 0.763 . . . . 0.0 112.613 -179.557 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.55 ' HB ' ' HZ2' ' A' ' 471' ' ' LYS . 9.2 p -113.51 155.8 24.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.559 -1.201 . . . . 0.0 108.333 177.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.756 ' HA ' HD12 ' A' ' 473' ' ' LEU . 0.6 OUTLIER -50.74 -43.75 58.23 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.53 -178.895 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.903 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -60.86 -56.92 15.49 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.153 0.502 . . . . 0.0 109.973 179.016 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -56.78 -19.87 19.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.963 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 1.016 ' CD1' HD11 ' A' ' 497' ' ' LEU . 5.9 mt -81.69 -37.89 26.68 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -179.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.882 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.4 OUTLIER -84.05 -42.53 16.04 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -178.719 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.611 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 26.3 mmtm -47.21 -27.41 1.48 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.686 0.279 . . . . 0.0 111.612 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.478 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -87.33 -40.27 14.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.996 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.532 ' CD2' HG22 ' A' ' 454' ' ' VAL . 15.7 m-85 -74.94 -0.46 18.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -46.31 173.51 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.027 0.441 . . . . 0.0 111.775 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 479' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 484' ' ' LEU . 36.9 p -55.01 -17.68 4.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.56 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 2.6 tmtm? -39.56 -32.11 0.12 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 8.2 mmmt -139.66 -63.77 0.5 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.631 0.253 . . . . 0.0 111.61 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.562 HG22 ' O ' ' A' ' 452' ' ' VAL . 11.9 p -58.71 -8.85 1.43 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.353 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 61.31 21.19 59.48 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.659 -178.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.818 HD21 HG11 ' A' ' 492' ' ' VAL . 9.1 tp -94.9 125.22 39.41 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.072 -0.564 . . . . 0.0 111.395 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.94 144.04 3.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.4 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 39.4 t -59.27 -20.03 50.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.786 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -94.61 -43.53 8.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.087 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.616 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.4 mt-30 -68.88 -40.75 79.05 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.184 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.513 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 41.4 m -50.87 -28.79 10.3 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.651 HG12 ' HG ' ' B' ' 593' ' ' LEU . 3.5 t -82.01 -41.96 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.395 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -59.52 -28.16 66.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.302 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.818 HG11 HD21 ' A' ' 484' ' ' LEU . 6.3 p -102.02 -6.95 9.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.019 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.612 HD21 ' CB ' ' A' ' 473' ' ' LEU . 10.2 tp -94.27 -44.77 7.8 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.801 0.334 . . . . 0.0 110.936 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.94 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -51.92 -38.1 55.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.207 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.435 ' HA ' ' NZ ' ' A' ' 498' ' ' LYS . 0.0 OUTLIER -61.32 -40.08 92.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.185 -179.368 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.761 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.5 mt -74.95 -50.14 26.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.046 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 1.016 HD11 ' CD1' ' A' ' 473' ' ' LEU . 0.5 OUTLIER -32.2 -44.15 0.09 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -178.194 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 1.002 ' HE3' HD12 ' B' ' 596' ' ' ILE . 0.1 OUTLIER -70.1 -38.16 75.59 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.576 ' HG3' ' HG2' ' A' ' 456' ' ' GLU . 1.4 mmm180 -58.79 -20.81 53.31 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.963 0.411 . . . . 0.0 110.578 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.775 HD11 HG11 ' A' ' 459' ' ' VAL . 67.4 mt -57.85 -47.58 82.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.86 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.55 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.7 t-20 60.58 58.85 3.92 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.143 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.55 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.0 Cg_endo -101.14 -162.71 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 124.168 3.245 . . . . 0.0 111.943 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.1 138.35 54.23 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.418 178.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.63 131.48 35.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.56 0.695 . . . . 0.0 112.104 -178.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.586 ' HE3' ' CE1' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -156.6 160.43 39.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.307 179.43 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.19 108.88 20.66 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.629 HG12 ' ND1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -89.62 110.81 22.18 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.52 178.185 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 64.28 42.53 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.154 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.3 t0 67.21 20.07 10.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.354 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.405 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.13 130.02 56.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.653 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 7.1 tpt -62.75 106.94 0.87 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.732 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.643 ' CD2' ' HB2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -124.55 156.15 37.84 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.883 -179.251 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.474 ' CZ ' HD23 ' B' ' 597' ' ' LEU . 0.2 OUTLIER -133.21 122.42 23.94 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.674 177.733 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.614 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.1 OUTLIER -177.76 169.33 2.07 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.064 0.459 . . . . 0.0 111.513 -179.456 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.796 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -123.67 168.0 13.24 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.935 178.59 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.444 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -137.87 106.28 5.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.976 179.558 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.513 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.159 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.82 0.343 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -60.38 92.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.842 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.627 ' O1P' HG21 ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -90.12 49.62 1.73 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.923 0.392 . . . . 0.0 110.614 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.562 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 3.0 pp20? -86.21 -40.62 15.4 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.751 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 587' ' ' ASP . . . . . 0.631 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.4 OUTLIER -84.24 -22.83 30.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.579 -179.391 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -51.7 -55.19 20.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.094 0.473 . . . . 0.0 111.769 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.638 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.6 p80 -78.69 -21.94 47.46 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.239 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.904 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.3 tp -58.83 -29.49 66.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.08 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 86.2 mt -85.96 -32.54 6.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.638 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.2 OUTLIER -71.71 -38.37 70.54 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.388 -0.525 . . . . 0.0 112.158 -178.995 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.814 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -70.58 -17.97 62.9 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.112 179.964 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.52 ' N ' HD13 ' B' ' 593' ' ' LEU . 4.2 pt-20 -62.25 -30.68 71.29 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.739 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.533 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 1.5 pt-20 -82.82 -42.96 17.22 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -179.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.667 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.0 pp -52.48 -26.48 9.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.228 0.537 . . . . 0.0 110.816 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.879 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.4 tp -72.85 -82.27 0.05 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.249 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.68 HG22 ' HG ' ' B' ' 597' ' ' LEU . 31.2 m -141.31 29.72 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.052 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.757 -177.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.533 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 26.2 mtp180 -140.82 39.83 1.83 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.303 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 600' ' ' VAL . . . . . 0.413 ' O ' HG22 ' B' ' 600' ' ' VAL . 9.6 p . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.099 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 2.5 p30 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.827 0.346 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.792 ' C ' HG22 ' A' ' 482' ' ' THR . 41.0 t -61.06 159.74 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.031 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.506 ' N ' HG12 ' A' ' 452' ' ' VAL . 1.1 mt-30 -148.21 133.65 18.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.89 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.578 HG22 ' CD2' ' A' ' 477' ' ' PHE . 26.6 t -59.37 109.72 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.793 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.425 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.2 p -131.65 167.69 19.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.716 0.77 . . . . 0.0 112.479 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.738 ' HA ' HG23 ' A' ' 496' ' ' ILE . 22.1 mt-10 -62.94 -53.08 59.62 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.645 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -27.42 68.82 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.533 -178.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.446 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -66.66 -58.34 5.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.911 0.386 . . . . 0.0 111.238 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.954 HG13 HD11 ' A' ' 473' ' ' LEU . 16.9 t -49.76 -31.68 6.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.187 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.575 ' HD3' HD23 ' A' ' 500' ' ' LEU . 1.0 OUTLIER -55.54 -47.31 76.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.396 178.97 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.46 ' HG2' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -60.73 -26.79 67.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.939 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.691 ' HD2' HD21 ' A' ' 473' ' ' LEU . 4.3 m-30 -73.35 -45.35 55.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.048 0.451 . . . . 0.0 110.314 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.04 HD11 HD13 ' A' ' 500' ' ' LEU . 2.5 mt -67.2 -58.46 4.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.842 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.564 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.2 OUTLIER -52.11 -23.84 6.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.908 0.385 . . . . 0.0 110.924 -179.788 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 -93.44 -44.24 8.35 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.308 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.461 ' HE2' ' HG2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -168.15 134.02 1.59 Allowed Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.005 -179.761 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.495 ' HA ' ' HB2' ' A' ' 514' ' ' SER . 30.6 Cg_endo -60.94 142.11 96.57 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.244 1.963 . . . . 0.0 112.607 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.592 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -128.07 178.74 6.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.329 -179.422 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.695 HG23 ' ND1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -119.34 154.26 33.85 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 177.369 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.529 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -51.24 -44.66 61.75 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.04 -0.664 . . . . 0.0 110.839 -179.34 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.831 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -65.6 -54.8 22.72 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.484 178.514 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 472' ' ' ASP . . . . . 0.426 ' HB3' ' H ' ' A' ' 469' ' ' THR . 24.9 t0 -58.65 -21.16 53.33 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.704 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.954 HD11 HG13 ' A' ' 459' ' ' VAL . 0.4 OUTLIER -80.14 -40.65 26.95 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 121.106 0.479 . . . . 0.0 111.628 -179.606 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.904 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.9 OUTLIER -83.8 -48.53 9.98 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.58 -178.968 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.597 ' HD3' HD12 ' A' ' 474' ' ' LEU . 29.9 mmtp -48.8 -26.72 2.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.693 0.282 . . . . 0.0 111.667 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.442 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -78.84 -36.16 42.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.1 179.869 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.59 ' HB2' HG21 ' A' ' 489' ' ' THR . 11.5 m-85 -67.24 -52.86 35.78 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.371 0.605 . . . . 0.0 111.009 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 478' ' ' GLN . . . . . 0.404 ' HB3' ' HA ' ' A' ' 486' ' ' SER . 0.0 OUTLIER -57.03 130.23 45.19 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.19 -179.362 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 74.78 3.2 4.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.82 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 11.6 tptp -83.32 -54.74 4.77 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.818 0.342 . . . . 0.0 110.892 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -177.78 -34.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.097 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.792 HG22 ' C ' ' A' ' 452' ' ' VAL . 11.9 p -55.14 -19.47 7.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.974 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 68.7 18.62 72.34 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.936 -179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.444 ' CD2' HG11 ' A' ' 492' ' ' VAL . 4.7 mp -94.97 126.42 40.3 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.018 0.437 . . . . 0.0 111.352 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.42 154.7 1.7 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.581 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 486' ' ' SER . . . . . 0.504 ' O ' HG23 ' A' ' 490' ' ' VAL . 53.2 p -62.31 -23.54 66.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.019 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -87.44 -51.97 5.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.558 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -62.02 -41.79 98.46 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.353 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.59 HG21 ' HB2' ' A' ' 477' ' ' PHE . 62.0 m -49.13 -39.69 29.53 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.744 HG13 HD22 ' A' ' 474' ' ' LEU . 2.3 t -66.42 -49.96 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.385 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.01 -28.36 9.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.762 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.444 HG11 ' CD2' ' A' ' 484' ' ' LEU . 7.1 p -102.04 -13.8 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.011 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 1.022 HD22 ' CD2' ' A' ' 497' ' ' LEU . 0.4 OUTLIER -89.49 -41.19 12.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 120.751 0.31 . . . . 0.0 110.841 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.549 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -50.52 -41.2 53.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.08 0.467 . . . . 0.0 110.774 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.402 ' OE1' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -65.85 -40.06 91.37 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.375 -179.929 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.738 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.4 mt -75.84 -39.17 37.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.914 -179.537 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 1.022 ' CD2' HD22 ' A' ' 493' ' ' LEU . 2.4 mm? -42.95 -60.34 1.66 Allowed 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -178.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.667 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.79 -28.76 67.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.862 0.363 . . . . 0.0 111.522 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -27.07 66.08 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.172 0.51 . . . . 0.0 110.609 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.04 HD13 HD11 ' A' ' 463' ' ' LEU . 45.0 mt -60.58 -47.41 86.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.744 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.576 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.2 t-20 57.22 58.25 7.8 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.743 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.576 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 78.7 Cg_endo -101.31 -159.63 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.428 0 C-N-CA 124.039 3.159 . . . . 0.0 111.504 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.0 141.8 48.07 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.927 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 504' ' ' ARG . . . . . 0.454 ' HB2' ' HE1' ' A' ' 511' ' ' MET . 4.3 ppt_? -79.58 135.32 36.57 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.293 0.568 . . . . 0.0 111.315 -179.028 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.4 mtmt -155.57 134.65 12.17 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.698 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.512 ' HB2' ' HE2' ' A' ' 506' ' ' MET . 12.4 ptm -82.83 110.43 17.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.013 0.435 . . . . 0.0 111.636 -179.312 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.484 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.68 111.0 22.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.748 178.973 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 58.9 t30 60.4 38.72 19.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.913 0.387 . . . . 0.0 110.464 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 3.5 t0 78.58 11.79 1.62 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.408 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 507' ' ' ILE . 0.0 OUTLIER -116.26 125.48 52.26 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.694 0.283 . . . . 0.0 111.271 179.83 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.552 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -57.47 109.07 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.987 0.422 . . . . 0.0 110.954 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.695 ' ND1' HG23 ' A' ' 469' ' ' THR . 9.2 m80 -120.43 138.72 53.63 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.722 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.711 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -107.49 124.17 49.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.279 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.495 ' HB2' ' HA ' ' A' ' 467' ' ' PRO . 0.6 OUTLIER -170.34 169.36 7.63 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.997 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.608 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.1 pt? -128.9 169.02 15.13 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.893 -1.048 . . . . 0.0 108.997 178.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.409 ' H ' ' HD2' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -129.67 106.54 8.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.017 0.437 . . . . 0.0 111.289 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.564 ' HG2' HG22 ' A' ' 464' ' ' THR . 4.8 pt-20 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.251 -0.88 . . . . 0.0 111.02 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.826 0.346 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.28 87.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.847 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.559 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -90.12 49.8 1.76 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.956 0.408 . . . . 0.0 110.699 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.604 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 12.6 pt-20 -86.0 -48.66 8.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.638 179.381 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 587' ' ' ASP . . . . . 0.487 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.4 OUTLIER -53.5 -22.34 7.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.565 -179.875 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -50.86 -44.65 59.64 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.921 0.391 . . . . 0.0 111.331 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.604 ' CE1' ' O ' ' B' ' 586' ' ' GLU . 2.3 p80 -80.31 -21.93 42.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.577 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.922 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.6 tp -55.86 -31.74 63.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.998 0.428 . . . . 0.0 110.861 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.1 mt -85.91 -29.53 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.998 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.544 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.77 -39.81 91.39 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.634 -179.436 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.858 HD23 ' CB ' ' A' ' 494' ' ' ALA . 0.0 OUTLIER -78.63 -18.58 54.28 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.084 0.468 . . . . 0.0 110.037 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.826 ' N ' HD13 ' B' ' 593' ' ' LEU . 52.3 tt0 -63.53 -34.19 77.25 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.445 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.466 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 6.5 pt-20 -76.68 -44.7 32.6 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -178.351 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.987 HD12 ' HE2' ' A' ' 498' ' ' LYS . 2.9 pt -50.66 -26.87 4.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 121.158 0.504 . . . . 0.0 111.789 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.786 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.9 tp -75.36 -80.67 0.08 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.43 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.697 HG13 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -141.89 30.9 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.116 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.602 -177.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.466 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 25.4 mtp85 -142.31 41.84 1.63 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.437 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 8.8 m . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.081 179.958 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.854 0.359 . . . . 0.0 111.299 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.753 HG13 HG22 ' A' ' 482' ' ' THR . 8.1 p -171.69 159.77 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.061 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.492 ' N ' HG22 ' A' ' 452' ' ' VAL . 0.2 OUTLIER -149.98 135.61 18.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.843 0.354 . . . . 0.0 110.953 -179.734 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.665 HG22 ' CD2' ' A' ' 477' ' ' PHE . 12.5 t -68.59 112.74 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.332 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.551 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.8 p -131.78 165.97 22.59 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.607 0.717 . . . . 0.0 112.485 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.756 ' HA ' HG23 ' A' ' 496' ' ' ILE . 16.9 mt-10 -61.24 -53.74 53.01 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.54 179.098 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.49 -28.07 65.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.206 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.425 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -74.1 -38.26 63.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.701 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.807 ' HB ' HD21 ' A' ' 500' ' ' LEU . 15.7 t -70.59 -37.92 71.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.206 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 2.0 mmm-85 -52.54 -54.82 27.61 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.481 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -56.45 -27.46 56.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.85 179.497 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.487 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 17.5 m-30 -73.52 -46.96 44.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.13 179.091 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.015 HD11 HD13 ' A' ' 500' ' ' LEU . 2.1 mt -65.79 -57.44 7.97 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.407 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.714 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.2 OUTLIER -48.27 -27.54 2.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.11 0.481 . . . . 0.0 110.421 179.933 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.493 ' O ' ' HG2' ' A' ' 466' ' ' LYS . 10.8 ttt85 -88.58 -54.08 4.34 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.648 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.538 ' HD3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -158.81 152.13 18.84 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.974 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.567 ' HB2' ' HB3' ' A' ' 512' ' ' HIS . 80.9 Cg_endo -72.97 175.86 9.85 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.619 2.213 . . . . 0.0 112.94 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.697 ' HG3' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -168.46 166.25 12.28 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.204 0.526 . . . . 0.0 112.044 -178.719 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.614 HG22 ' CD2' ' A' ' 512' ' ' HIS . 4.1 p -105.36 154.97 19.57 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 177.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.76 ' HA ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -55.64 -33.71 64.29 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.141 -179.564 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.878 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.1 OUTLIER -69.38 -52.03 31.02 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.309 0.576 . . . . 0.0 109.463 178.9 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -58.82 -31.13 68.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.378 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.939 ' CD1' HD11 ' A' ' 497' ' ' LEU . 3.2 mt -64.7 -48.58 74.15 Favored 'General case' 0 CA--C 1.522 -0.099 0 CA-C-O 120.939 0.399 . . . . 0.0 111.271 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.922 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.8 OUTLIER -79.67 -32.09 41.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.956 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.401 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -58.73 -26.83 64.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.175 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -86.28 -43.05 13.24 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.587 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.665 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.8 m-85 -67.4 -68.76 0.36 Allowed 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.488 0.661 . . . . 0.0 110.192 179.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.27 174.44 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.594 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 479' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' A' ' 484' ' ' LEU . 12.7 t -73.04 -6.27 44.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.349 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -45.48 -29.21 1.07 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.782 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' LYS . . . . . 0.522 ' CB ' HG12 ' A' ' 452' ' ' VAL . 0.3 OUTLIER -136.87 -57.77 0.72 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.089 -0.244 . . . . 0.0 111.509 -179.843 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.753 HG22 HG13 ' A' ' 452' ' ' VAL . 19.1 p -53.66 -14.46 0.89 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.239 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 65.48 18.36 65.51 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.373 -0.918 . . . . 0.0 111.066 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.565 ' CD2' HG11 ' A' ' 492' ' ' VAL . 3.3 mp -106.83 121.43 44.38 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 120.914 0.388 . . . . 0.0 111.277 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -41.37 152.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.913 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 486' ' ' SER . . . . . 0.544 ' O ' HG23 ' A' ' 490' ' ' VAL . 2.2 p -61.56 -24.72 66.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.07 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -84.36 -53.51 5.41 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.531 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -59.93 -43.46 94.92 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.034 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 54.9 m -47.78 -32.26 5.79 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-O 121.194 0.521 . . . . 0.0 109.704 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.868 HG22 HD22 ' A' ' 474' ' ' LEU . 3.9 t -75.62 -45.47 38.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.04 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -56.51 -27.36 57.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.118 179.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.565 HG11 ' CD2' ' A' ' 484' ' ' LEU . 8.3 p -102.11 -12.77 8.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.087 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.621 HD23 ' HB3' ' A' ' 474' ' ' LEU . 10.2 tp -89.39 -41.3 12.19 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.786 0.327 . . . . 0.0 110.913 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.923 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -53.99 -41.04 67.48 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.013 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.7 OUTLIER -57.17 -41.37 79.13 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.432 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.756 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.8 mt -79.84 -31.2 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -177.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.939 HD11 ' CD1' ' A' ' 473' ' ' LEU . 1.7 mm? -51.07 -50.29 58.98 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -178.094 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.987 ' HE2' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -69.44 -24.26 63.79 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -177.875 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.551 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 10.5 mmm-85 -61.94 -19.58 62.88 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.226 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.015 HD13 HD11 ' A' ' 463' ' ' LEU . 23.1 mt -66.08 -47.68 73.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.26 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.551 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.5 t-20 56.96 59.37 7.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.547 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.551 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 84.4 Cg_endo -101.02 -157.96 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.375 0 C-N-CA 123.918 3.079 . . . . 0.0 111.465 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.08 139.66 53.02 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.082 179.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.62 135.75 36.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.258 0.551 . . . . 0.0 111.478 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -154.72 160.08 41.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.733 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -104.97 108.9 20.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.902 0.382 . . . . 0.0 111.691 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.542 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.92 110.82 22.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.067 178.951 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 58.88 44.22 16.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.056 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.1 t70 74.32 8.1 4.57 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.47 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.45 ' O ' ' N ' ' A' ' 507' ' ' ILE . 1.5 tpmt? -113.48 130.79 56.25 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-O 120.651 0.262 . . . . 0.0 110.754 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 5.4 tpt -67.54 108.69 2.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.051 0.453 . . . . 0.0 110.994 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.614 ' CD2' HG22 ' A' ' 469' ' ' THR . 12.0 m170 -122.45 138.17 54.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.632 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.693 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -105.15 133.2 50.31 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.96 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.462 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -176.87 169.24 2.46 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.918 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.592 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.3 pt? -129.76 168.9 15.84 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.196 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.406 ' H ' ' HD2' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -133.12 106.48 7.64 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.01 0.434 . . . . 0.0 111.438 179.78 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.714 ' HB2' HG22 ' A' ' 464' ' ' THR . 4.5 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.827 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.693 0.282 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -66.32 76.42 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.957 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.603 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -90.17 49.69 1.74 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.903 0.382 . . . . 0.0 110.795 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.611 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 3.0 pp20? -86.25 -45.75 10.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.725 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 587' ' ' ASP . . . . . 0.587 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.6 OUTLIER -53.39 -22.23 7.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.752 -179.652 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 -50.48 -45.77 56.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.93 0.395 . . . . 0.0 111.354 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.719 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 2.3 p80 -80.29 -21.88 42.18 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.351 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.943 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.7 tp -64.99 -28.99 69.89 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.324 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 77.9 mt -85.51 -32.71 7.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.719 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.58 -39.29 70.66 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.464 -0.495 . . . . 0.0 111.837 -179.243 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.815 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -70.72 -17.9 62.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.202 0.525 . . . . 0.0 110.081 -179.822 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.774 ' N ' HD13 ' B' ' 593' ' ' LEU . 3.8 pt-20 -63.21 -30.8 71.87 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.012 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.502 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 2.7 pt-20 -83.01 -43.0 16.86 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.696 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.9 pp -52.22 -26.59 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.196 0.522 . . . . 0.0 110.935 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.877 HD22 ' HG ' ' A' ' 497' ' ' LEU . 11.8 tp -69.56 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.336 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.694 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -144.24 30.72 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 CA-C-N 114.693 -1.139 . . . . 0.0 110.575 -178.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.502 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 54.9 mtp180 -138.68 43.68 2.1 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.141 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 30.1 m . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.137 179.989 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.828 0.347 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.887 HG22 ' H ' ' A' ' 453' ' ' GLN . 8.7 p -62.99 -147.16 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.356 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.887 ' H ' HG22 ' A' ' 452' ' ' VAL . 2.1 mm-40 91.26 114.61 0.03 OUTLIER 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 124.236 1.015 . . . . 0.0 109.078 -178.05 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.812 HG23 HG21 ' A' ' 482' ' ' THR . 19.3 t -57.72 117.93 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.674 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 26.3 p -131.55 173.39 11.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.644 0.735 . . . . 0.0 112.66 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.669 ' HA ' HG23 ' A' ' 496' ' ' ILE . 15.1 mt-10 -68.04 -53.07 28.5 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.385 179.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.83 -28.8 62.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.192 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -70.04 -58.24 4.05 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.748 0.309 . . . . 0.0 111.347 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.806 HG13 HD11 ' A' ' 473' ' ' LEU . 19.2 t -51.75 -26.31 6.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.759 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.591 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.3 mmm-85 -63.09 -44.42 95.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.804 0.335 . . . . 0.0 110.336 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.452 ' HG2' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -61.74 -24.98 67.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.504 179.684 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.507 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 4.0 m-30 -71.61 -46.37 59.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.998 0.428 . . . . 0.0 110.153 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.071 HD11 HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -65.91 -58.29 5.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.479 -179.92 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.742 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -50.46 -23.92 2.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.932 0.396 . . . . 0.0 110.599 179.788 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.5 mtt85 -94.11 -42.67 8.87 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.417 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.466 ' HD2' ' O ' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -173.36 156.28 2.85 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 120.766 0.317 . . . . 0.0 111.27 -179.737 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.615 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 71.8 Cg_endo -73.62 147.3 40.21 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.743 2.295 . . . . 0.0 113.463 -179.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.762 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -143.35 149.58 37.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.846 -179.702 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.626 HG22 ' O ' ' A' ' 511' ' ' MET . 12.1 p -90.14 177.37 6.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 176.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.87 HG22 ' CD2' ' A' ' 497' ' ' LEU . 0.5 OUTLIER -70.97 -34.96 71.92 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.147 -0.621 . . . . 0.0 111.06 -179.735 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.873 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -72.48 -49.5 32.69 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.661 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -60.77 -34.49 74.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.691 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.808 HD22 HD11 ' A' ' 493' ' ' LEU . 0.9 OUTLIER -64.19 -42.22 96.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.973 0.416 . . . . 0.0 110.9 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 1.026 HD22 HG22 ' A' ' 490' ' ' VAL . 3.0 pp -84.13 -33.06 24.37 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.741 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.636 ' N ' HD12 ' A' ' 474' ' ' LEU . 0.1 OUTLIER -49.06 -26.83 2.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.617 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -86.09 -43.63 12.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.492 -179.825 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.621 ' CE2' HG22 ' A' ' 454' ' ' VAL . 5.4 m-85 -61.29 -40.16 93.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.112 0.482 . . . . 0.0 111.406 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -57.58 116.74 3.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.149 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 75.27 3.28 4.03 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.893 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.81 -54.41 6.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.881 0.372 . . . . 0.0 110.911 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? 177.1 -27.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.21 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.812 HG21 HG23 ' A' ' 454' ' ' VAL . 0.0 OUTLIER -47.03 -25.39 0.81 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.863 0.363 . . . . 0.0 111.079 179.532 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 66.65 15.19 63.83 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.653 -0.785 . . . . 0.0 111.856 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.999 HD23 HG11 ' A' ' 492' ' ' VAL . 1.1 mp -95.59 127.54 41.71 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.016 0.436 . . . . 0.0 111.028 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.78 155.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.709 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.5 m -60.63 -22.64 64.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.129 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -91.23 -44.93 8.92 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.61 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.752 ' O ' HG12 ' A' ' 492' ' ' VAL . 2.2 mt-30 -65.41 -40.62 93.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.115 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 70.2 m -51.02 -28.57 10.4 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.21 0.529 . . . . 0.0 109.595 178.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 1.026 HG22 HD22 ' A' ' 474' ' ' LEU . 14.4 t -84.97 -41.64 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.831 178.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 491' ' ' ASN . . . . . 0.463 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 7.1 t30 -60.96 -29.22 69.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.025 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.999 HG11 HD23 ' A' ' 484' ' ' LEU . 7.3 p -98.6 -7.25 9.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.924 179.477 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.808 HD11 HD22 ' A' ' 473' ' ' LEU . 39.2 tp -94.61 -46.89 6.76 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 121.029 0.442 . . . . 0.0 110.714 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.671 ' CB ' HD23 ' B' ' 593' ' ' LEU . . . -49.74 -34.12 18.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.401 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.7 OUTLIER -68.35 -44.07 76.09 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.72 -179.493 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.669 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.5 mt -79.39 -32.64 14.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.877 ' HG ' HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -44.12 -56.99 3.65 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.589 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.696 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.9 -33.36 71.75 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -178.097 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.575 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 14.3 mmm180 -56.64 -22.18 32.44 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.981 0.42 . . . . 0.0 110.814 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.071 HD22 HD11 ' A' ' 463' ' ' LEU . 93.6 mt -59.64 -47.6 84.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.171 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.595 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.0 t-20 58.36 57.48 6.41 Favored Pre-proline 0 C--N 1.32 -0.716 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.311 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.595 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 56.5 Cg_endo -99.84 -159.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 124.137 3.225 . . . . 0.0 111.363 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.8 139.78 52.65 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.771 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 5.3 ptt-85 -79.64 133.44 36.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.488 0.661 . . . . 0.0 111.5 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -156.25 160.21 39.58 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.664 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.403 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -103.86 110.39 22.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.995 0.426 . . . . 0.0 111.502 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.483 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.64 110.86 22.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.942 179.085 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.3 t30 59.8 43.13 15.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.841 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 73.28 12.36 4.85 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.35 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.413 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -116.1 131.38 56.96 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.866 179.826 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.626 ' O ' HG22 ' A' ' 469' ' ' THR . 28.9 mmm -62.9 108.49 1.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.061 0.457 . . . . 0.0 110.552 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.493 ' CE1' HG23 ' A' ' 469' ' ' THR . 23.7 m80 -122.76 125.52 45.65 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.081 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.626 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -104.92 123.37 47.63 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 178.71 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.615 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER 179.43 169.37 1.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.08 0.467 . . . . 0.0 111.33 -178.952 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.791 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -118.78 168.7 10.5 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.641 178.547 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.43 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -136.9 106.05 6.0 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.082 0.467 . . . . 0.0 111.219 179.54 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.742 ' HG2' HG22 ' A' ' 464' ' ' THR . 3.2 pt-20 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.087 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.838 0.352 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.18 94.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.935 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.606 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -87.05 49.08 1.75 Allowed 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 120.906 0.384 . . . . 0.0 110.741 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.578 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 12.7 pt-20 -86.54 -34.74 19.87 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.371 0.605 . . . . 0.0 110.288 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 587' ' ' ASP . . . . . 0.408 ' HA ' ' HB3' ' B' ' 590' ' ' LEU . 1.3 p-10 -84.25 -22.92 30.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.541 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -56.15 -55.25 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.083 0.468 . . . . 0.0 111.699 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.692 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.9 p80 -76.57 -21.97 54.93 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.319 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.925 ' CD1' HD21 ' A' ' 474' ' ' LEU . 19.5 tp -61.06 -29.32 69.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.452 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 82.6 mt -85.92 -34.4 8.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.692 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.4 OUTLIER -71.53 -40.74 69.87 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 120.51 -0.476 . . . . 0.0 112.163 -178.812 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.836 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.4 -18.62 65.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.211 0.529 . . . . 0.0 110.052 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.536 ' N ' HD13 ' B' ' 593' ' ' LEU . 14.3 tt0 -63.62 -30.41 71.52 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.551 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.645 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.5 OUTLIER -77.52 -48.05 18.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.241 -178.945 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.856 HD11 ' HB1' ' A' ' 494' ' ' ALA . 1.6 pp -51.16 -26.68 5.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.103 0.478 . . . . 0.0 110.94 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.997 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.2 tp -62.48 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.541 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.696 HG22 ' HG ' ' B' ' 597' ' ' LEU . 34.9 m -136.1 37.13 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.06 0 CA-C-N 114.877 -1.056 . . . . 0.0 111.245 -177.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.645 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 17.3 mtp180 -129.71 102.05 6.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.062 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 28.2 m . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.211 179.877 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.849 0.357 . . . . 0.0 111.296 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.736 ' O ' HG22 ' A' ' 482' ' ' THR . 7.2 p -173.45 144.29 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.984 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -124.13 135.34 53.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.813 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.617 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.1 t -60.3 116.85 1.94 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.802 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.521 ' O ' HG23 ' A' ' 459' ' ' VAL . 28.2 p -131.65 167.97 18.54 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.585 0.707 . . . . 0.0 112.533 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.59 ' HA ' HG23 ' A' ' 496' ' ' ILE . 17.7 mt-10 -65.1 -54.87 23.33 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.188 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -50.59 -28.39 8.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.654 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.412 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -76.92 -35.83 57.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.762 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.875 HG12 HD21 ' A' ' 500' ' ' LEU . 13.2 t -76.1 -31.89 22.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.709 0.29 . . . . 0.0 111.446 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.539 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.1 mmm180 -61.43 -41.24 96.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.211 179.527 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.454 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -65.81 -29.01 69.42 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.407 179.275 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.454 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 11.4 m-30 -64.3 -45.74 86.66 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.051 HD11 HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -64.56 -59.05 4.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.876 179.534 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.639 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.82 -26.6 1.7 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.234 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -88.89 -49.32 6.87 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.809 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.446 ' HD3' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -171.78 162.81 4.72 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.114 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.504 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 97.4 Cg_endo -80.37 160.08 22.82 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.763 2.309 . . . . 0.0 113.292 -179.156 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.631 ' HE3' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -157.21 168.2 28.11 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.369 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.589 HG22 ' CD2' ' A' ' 512' ' ' HIS . 4.6 p -100.75 176.1 5.42 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 176.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.429 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -71.33 -30.85 66.69 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 119.992 -0.683 . . . . 0.0 111.401 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.856 ' HB3' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -77.17 -50.17 13.56 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.569 0.699 . . . . 0.0 109.388 178.53 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -57.91 -31.4 66.73 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.12 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.644 HD11 HG13 ' A' ' 459' ' ' VAL . 0.9 OUTLIER -70.49 -39.22 74.31 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-O 120.989 0.423 . . . . 0.0 110.664 179.852 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.925 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.1 pp -84.2 -33.15 24.22 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.938 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.581 ' N ' HD12 ' A' ' 474' ' ' LEU . 0.0 OUTLIER -47.42 -27.67 1.79 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.372 -179.058 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.452 ' HE3' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -85.35 -43.08 13.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.171 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.617 ' CE2' HG22 ' A' ' 454' ' ' VAL . 10.0 m-85 -64.38 -42.04 96.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.109 0.48 . . . . 0.0 111.26 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 478' ' ' GLN . . . . . 0.604 ' O ' HG22 ' A' ' 479' ' ' THR . 30.4 mt-30 -54.06 113.99 1.44 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.042 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 479' ' ' THR . . . . . 0.604 HG22 ' O ' ' A' ' 478' ' ' GLN . 0.5 OUTLIER 76.75 3.18 3.42 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.495 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -64.55 -54.19 36.02 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.815 0.341 . . . . 0.0 110.876 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' LYS . . . . . 0.694 ' HB3' HG12 ' A' ' 452' ' ' VAL . 0.0 OUTLIER 178.14 -30.1 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.255 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.736 HG22 ' O ' ' A' ' 452' ' ' VAL . 8.1 p -50.96 -21.91 2.0 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.041 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 65.45 16.31 62.73 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.815 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.828 ' CD2' HG11 ' A' ' 492' ' ' VAL . 0.7 OUTLIER -86.05 130.05 34.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 120.937 0.398 . . . . 0.0 111.131 -179.697 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -43.9 149.93 0.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.669 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.76 -21.65 61.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.467 179.125 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -91.59 -49.17 6.44 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.716 179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.628 ' O ' HG12 ' A' ' 492' ' ' VAL . 6.7 mt-30 -62.57 -42.09 99.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.31 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 87.1 m -49.11 -29.6 5.47 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.246 0.546 . . . . 0.0 109.692 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.883 HG22 HD22 ' A' ' 474' ' ' LEU . 13.7 t -83.12 -41.99 17.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.061 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -59.81 -31.97 70.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.063 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.828 HG11 ' CD2' ' A' ' 484' ' ' LEU . 7.6 p -94.86 -11.62 8.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.825 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.642 HD11 HD22 ' A' ' 497' ' ' LEU . 11.5 tp -90.22 -44.89 9.44 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.926 0.393 . . . . 0.0 110.777 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.856 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -50.76 -33.9 25.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.569 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.81 -40.56 83.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.789 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.59 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.7 mt -77.99 -43.42 28.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.997 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.2 OUTLIER -37.77 -56.24 1.1 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -178.466 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.698 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.78 -23.56 63.38 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.557 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.488 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 0.1 OUTLIER -64.74 -18.53 65.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.137 0.494 . . . . 0.0 110.204 179.114 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.051 HD22 HD11 ' A' ' 463' ' ' LEU . 29.9 mt -59.7 -47.59 85.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.104 -179.164 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.644 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.8 t-20 56.63 54.99 8.24 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.287 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.644 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.2 Cg_endo -101.41 -160.27 0.04 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 124.249 3.3 . . . . 0.0 111.67 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.75 141.29 48.76 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.658 178.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.64 133.55 36.4 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.4 0.619 . . . . 0.0 111.512 -178.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -156.29 160.18 39.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.007 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.12 109.78 21.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.866 0.365 . . . . 0.0 111.347 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.498 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -90.73 110.86 22.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.021 179.071 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 58.6 t30 58.88 44.91 15.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.804 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.2 t70 71.57 13.24 6.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.201 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.401 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.09 127.59 54.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.636 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.16 108.51 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.921 0.391 . . . . 0.0 110.438 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.589 ' CD2' HG22 ' A' ' 469' ' ' THR . 9.0 m-70 -122.47 128.22 50.58 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.946 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.636 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -104.89 122.88 46.71 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.733 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.504 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER 179.25 169.33 1.01 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.069 0.461 . . . . 0.0 111.437 -178.757 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.79 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -120.34 168.88 10.83 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.521 178.331 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.01 106.15 7.09 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.136 0.494 . . . . 0.0 111.204 179.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.639 ' HG2' HG22 ' A' ' 464' ' ' THR . 2.7 pt-20 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.057 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.833 0.349 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.94 100.02 0.19 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.085 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.868 ' O3P' HG22 ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -90.17 49.67 1.74 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 120.956 0.408 . . . . 0.0 110.617 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.496 ' HA ' ' CE1' ' B' ' 589' ' ' HIS . 12.2 pt-20 -86.13 -38.26 17.92 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.771 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.15 -22.68 33.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.597 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -50.93 -55.21 18.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.953 0.406 . . . . 0.0 111.719 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.659 ' O ' HD12 ' B' ' 593' ' ' LEU . 1.5 p80 -80.11 -21.9 42.75 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.164 -179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.9 ' CD1' HD21 ' A' ' 474' ' ' LEU . 39.7 tp -54.43 -47.6 72.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.004 0.43 . . . . 0.0 110.859 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 48.9 mt -86.24 -29.6 6.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.785 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.584 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.06 -45.46 77.29 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.387 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 1.111 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -67.96 -20.34 65.05 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.172 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.623 ' N ' HD13 ' B' ' 593' ' ' LEU . 5.8 tt0 -63.44 -30.86 71.92 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.323 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.435 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.3 OUTLIER -70.83 -45.83 63.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.532 -179.537 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 1.059 HD11 ' HB1' ' A' ' 494' ' ' ALA . 5.1 pt -58.14 -26.62 29.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.307 0.575 . . . . 0.0 110.678 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.874 HD13 ' HB3' ' A' ' 497' ' ' LEU . 12.2 tp -72.31 -81.74 0.05 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.1 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.754 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.7 m -141.76 30.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.059 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.593 -177.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.435 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 7.0 mtp180 -138.82 39.0 2.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.272 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 600' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 600' ' ' VAL . 27.4 m . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.195 -0.907 . . . . 0.0 111.168 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.755 0.312 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.764 ' O ' HG22 ' A' ' 482' ' ' THR . 7.4 p -63.62 123.13 15.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.923 0.392 . . . . 0.0 111.148 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.46 133.42 53.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.195 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.764 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.2 t -63.92 121.86 13.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.382 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 459' ' ' VAL . 35.0 p -131.49 170.71 14.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.689 0.757 . . . . 0.0 112.779 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.733 ' HA ' HG23 ' A' ' 496' ' ' ILE . 23.8 mt-10 -69.06 -52.97 22.98 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.328 -1.305 . . . . 0.0 110.73 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.92 -27.5 68.86 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.314 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.466 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -69.71 -36.71 76.15 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.458 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.879 ' HB ' HD21 ' A' ' 500' ' ' LEU . 15.6 t -70.67 -36.92 67.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.808 0.337 . . . . 0.0 110.911 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.583 ' HD3' HD23 ' A' ' 500' ' ' LEU . 1.5 mmm-85 -52.76 -49.56 65.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.953 178.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.532 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -61.66 -23.74 66.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.014 179.8 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.54 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 8.4 m-30 -75.17 -42.62 55.57 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.223 0.535 . . . . 0.0 109.605 178.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.04 HD11 HD13 ' A' ' 500' ' ' LEU . 1.8 mt -69.46 -57.66 4.97 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.454 -179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.672 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.1 OUTLIER -48.28 -27.58 2.58 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.091 0.472 . . . . 0.0 110.364 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.656 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 15.2 mtt180 -83.96 -55.75 4.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.517 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.656 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER -163.72 146.37 7.78 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.657 -179.936 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.577 ' HG2' HG13 ' A' ' 507' ' ' ILE . 43.9 Cg_endo -68.1 161.52 44.05 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.64 2.227 . . . . 0.0 113.139 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.595 ' CE ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -159.64 166.61 30.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.567 -179.227 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.883 HG22 ' O ' ' A' ' 511' ' ' MET . 51.8 p -98.73 178.56 4.94 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 470' ' ' THR . . . . . 1.111 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -71.19 -40.74 71.02 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.612 179.703 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.783 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -64.47 -52.2 59.19 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.264 0.554 . . . . 0.0 109.852 179.013 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 472' ' ' ASP . . . . . 0.41 ' H ' ' HG2' ' A' ' 471' ' ' LYS . 46.3 t0 -59.94 -25.04 64.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.621 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.86 HD11 HG13 ' A' ' 459' ' ' VAL . 1.4 tt -86.13 -45.47 11.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.004 0.431 . . . . 0.0 111.616 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.9 HD21 ' CD1' ' B' ' 590' ' ' LEU . 3.6 pp -76.09 -44.1 40.36 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.087 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.557 ' N ' HD12 ' A' ' 474' ' ' LEU . 0.1 OUTLIER -52.34 -24.27 7.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.681 0.277 . . . . 0.0 111.204 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.592 ' HG2' ' N ' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -76.99 -44.43 31.09 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.521 -179.424 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.764 ' CE2' HG22 ' A' ' 454' ' ' VAL . 9.1 m-85 -60.6 -48.41 81.92 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.593 0.711 . . . . 0.0 109.753 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 478' ' ' GLN . . . . . 0.492 ' O ' ' O ' ' A' ' 477' ' ' PHE . 3.2 mm-40 44.17 174.93 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.496 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 479' ' ' THR . . . . . 0.57 HG23 ' C ' ' A' ' 484' ' ' LEU . 1.3 m -80.3 3.07 22.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.272 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.59 -58.05 3.71 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 481' ' ' LYS . . . . . 0.48 ' CB ' HG12 ' A' ' 452' ' ' VAL . 3.2 mppt? -118.84 -44.5 2.62 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -179.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.764 HG22 ' O ' ' A' ' 452' ' ' VAL . 16.2 p -51.51 -18.23 1.03 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.238 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 63.69 18.97 62.3 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.51 -0.853 . . . . 0.0 111.266 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.808 ' CD2' HG11 ' A' ' 492' ' ' VAL . 5.0 mp -107.04 122.67 46.92 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.963 0.411 . . . . 0.0 111.116 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.66 158.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.704 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 14.7 m -60.84 -27.2 67.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.127 0.489 . . . . 0.0 110.089 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -86.95 -46.63 9.69 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.415 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.474 ' O ' HG12 ' A' ' 492' ' ' VAL . 4.2 mt-30 -63.2 -40.34 97.21 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.0 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 96.7 m -50.71 -28.07 8.32 Favored 'General case' 0 C--N 1.335 -0.058 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.746 HG13 HD22 ' A' ' 474' ' ' LEU . 4.6 t -82.05 -44.16 19.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.107 179.12 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -56.31 -25.85 50.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.754 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.808 HG11 ' CD2' ' A' ' 484' ' ' LEU . 6.9 p -100.31 -14.17 7.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.546 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.633 HD23 ' CB ' ' A' ' 474' ' ' LEU . 0.2 OUTLIER -91.0 -35.22 14.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.888 0.375 . . . . 0.0 110.91 -179.776 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 1.059 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -58.33 -38.54 77.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.273 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.6 OUTLIER -63.13 -40.83 98.72 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.424 -179.614 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.733 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.3 mt -79.02 -44.31 24.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.569 -178.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.874 ' HB3' HD13 ' B' ' 597' ' ' LEU . 2.3 mm? -41.15 -50.91 3.5 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.888 ' NZ ' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -64.26 -33.17 75.21 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.873 0.368 . . . . 0.0 111.948 -178.768 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.469 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 0.7 OUTLIER -55.9 -23.3 30.53 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.003 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.04 HD13 HD11 ' A' ' 463' ' ' LEU . 56.8 mt -59.99 -47.54 85.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.924 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.547 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 24.9 t-20 58.13 59.94 6.18 Favored Pre-proline 0 C--N 1.32 -0.715 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.503 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.547 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 84.7 Cg_endo -101.06 -157.29 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.306 0 C-N-CA 123.966 3.111 . . . . 0.0 111.419 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.01 140.44 51.91 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.012 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.8 135.14 36.41 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.337 0.589 . . . . 0.0 111.579 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 14.7 mtmt -156.11 159.26 38.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.587 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.415 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -105.17 111.65 24.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.031 0.443 . . . . 0.0 111.722 -179.64 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.577 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.89 110.94 22.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.001 179.0 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 9.4 t30 58.62 42.96 19.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.836 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 74.45 12.38 3.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.391 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 507' ' ' ILE . 0.0 OUTLIER -116.17 130.96 57.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.854 179.824 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.883 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.97 109.1 1.68 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.962 0.41 . . . . 0.0 111.022 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.563 ' CD2' HG23 ' A' ' 469' ' ' THR . 11.1 m170 -122.31 138.21 54.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.886 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.707 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.1 OUTLIER -111.13 128.33 55.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.114 179.408 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.539 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -179.89 169.24 1.28 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.239 0.542 . . . . 0.0 112.16 -179.097 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.684 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.2 pt? -122.03 169.19 11.08 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.206 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.6 106.62 8.3 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.418 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.672 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.107 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.837 0.351 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.4 86.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.988 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.619 ' O1P' HG21 ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -90.03 49.46 1.71 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 120.968 0.414 . . . . 0.0 110.737 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.593 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 11.9 pt-20 -86.19 -40.82 15.23 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.711 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 587' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' B' ' 590' ' ' LEU . 0.2 OUTLIER -84.45 -22.75 30.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.617 -179.464 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -52.06 -55.26 21.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.744 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.711 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.7 p80 -77.63 -21.86 51.61 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.251 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.953 ' CD1' HD21 ' A' ' 474' ' ' LEU . 23.4 tp -61.93 -29.46 70.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.344 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 76.0 mt -85.97 -34.64 8.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.711 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.67 -43.54 65.84 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 120.346 -0.542 . . . . 0.0 112.065 -179.018 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 1.121 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -64.08 -18.85 64.79 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.166 -179.656 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.625 ' N ' HD13 ' B' ' 593' ' ' LEU . 3.7 pt-20 -63.55 -30.74 71.81 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.721 ' OE1' HG23 ' B' ' 600' ' ' VAL . 0.3 OUTLIER -74.8 -48.48 25.14 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.97 -179.357 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.621 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.1 pp -53.72 -26.52 13.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.275 0.559 . . . . 0.0 110.721 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.942 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.1 tp -71.85 -82.44 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.969 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.718 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.4 m -141.66 30.53 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.76 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.459 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.2 OUTLIER -139.17 37.99 2.11 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.396 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 600' ' ' VAL . . . . . 0.721 HG23 ' OE1' ' B' ' 595' ' ' GLU . 9.4 p . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.052 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.911 0.386 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.606 ' C ' HG22 ' A' ' 482' ' ' THR . 39.5 t -60.07 158.85 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.141 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.498 ' N ' HG12 ' A' ' 452' ' ' VAL . 0.0 OUTLIER -149.92 132.33 15.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.696 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.624 HG22 ' CE2' ' A' ' 477' ' ' PHE . 3.9 t -79.99 110.33 15.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.693 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 459' ' ' VAL . 32.5 p -131.77 168.14 18.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.68 0.752 . . . . 0.0 112.578 -179.193 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.757 ' HA ' HG23 ' A' ' 496' ' ' ILE . 20.9 mt-10 -61.59 -53.33 57.65 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.359 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.41 ' HA ' ' HG2' ' A' ' 460' ' ' ARG . 0.2 OUTLIER -64.12 -27.86 69.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.237 -179.257 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.438 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -68.54 -35.81 77.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.363 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.899 ' HB ' HD21 ' A' ' 500' ' ' LEU . 19.0 t -73.52 -35.38 44.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.903 0.383 . . . . 0.0 110.865 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.62 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -52.98 -51.36 61.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.816 178.809 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.513 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -56.15 -30.33 62.02 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.794 179.693 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.704 ' HH ' ' HZ ' ' A' ' 477' ' ' PHE . 11.0 m-30 -71.25 -41.71 69.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.081 0.467 . . . . 0.0 110.205 179.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.019 HD11 HD13 ' A' ' 500' ' ' LEU . 1.9 mt -70.8 -58.96 3.09 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.446 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.704 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.56 -27.75 2.97 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.048 0.451 . . . . 0.0 110.756 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -85.91 -52.14 5.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.887 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -166.48 130.49 1.62 Allowed Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.904 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.512 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 12.2 Cg_endo -55.0 160.76 7.42 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.62 2.213 . . . . 0.0 112.708 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.713 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -154.23 178.0 10.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.457 0.646 . . . . 0.0 111.718 -179.156 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.729 HG22 ' CD2' ' A' ' 512' ' ' HIS . 1.3 p -111.24 159.54 17.81 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 470' ' ' THR . . . . . 1.121 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -53.9 -48.09 70.49 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.539 -179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.794 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -56.98 -53.45 57.88 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.251 179.555 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -62.65 -33.47 75.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.727 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.797 HD11 HG13 ' A' ' 459' ' ' VAL . 1.3 tt -70.53 -41.65 72.29 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 121.093 0.473 . . . . 0.0 111.418 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.953 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.4 pp -84.19 -37.3 22.03 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.241 -179.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.07 -40.45 61.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.749 0.309 . . . . 0.0 111.219 -179.435 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.447 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -61.97 -41.68 98.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.138 -179.842 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.704 ' HZ ' ' HH ' ' A' ' 462' ' ' TYR . 13.3 m-85 -65.95 -66.08 0.59 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.507 0.67 . . . . 0.0 110.464 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 52.11 174.28 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.323 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 11.7 t -74.06 -15.43 61.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.221 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.29 -8.25 53.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.572 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 481' ' ' LYS . . . . . 0.403 ' HD2' HG21 ' A' ' 452' ' ' VAL . 46.7 mmtt -119.75 -73.9 0.63 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.73 0.3 . . . . 0.0 111.507 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.606 HG22 ' C ' ' A' ' 452' ' ' VAL . 71.3 p -78.52 13.13 1.7 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.384 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 54.97 22.39 27.49 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.479 -0.867 . . . . 0.0 111.775 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.701 HD13 HG11 ' A' ' 492' ' ' VAL . 1.0 OUTLIER -104.97 123.47 47.83 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 120.997 0.427 . . . . 0.0 111.337 -179.305 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.92 158.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.582 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 486' ' ' SER . . . . . 0.494 ' O ' HG23 ' A' ' 490' ' ' VAL . 12.2 p -62.0 -25.03 67.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.971 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -89.0 -51.15 5.75 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.354 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.514 ' HB3' HD23 ' A' ' 484' ' ' LEU . 0.1 OUTLIER -60.2 -42.93 96.13 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.237 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 47.9 m -49.55 -37.69 28.14 Favored 'General case' 0 CA--C 1.522 -0.12 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 179.082 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.577 HG12 ' HG ' ' B' ' 593' ' ' LEU . 2.7 t -71.19 -46.75 64.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.065 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.79 -25.83 43.15 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.567 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.701 HG11 HD13 ' A' ' 484' ' ' LEU . 9.1 p -101.75 -14.48 8.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.541 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.922 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.1 OUTLIER -91.41 -35.74 14.2 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.968 0.414 . . . . 0.0 110.543 179.928 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.611 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -56.44 -37.01 69.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.092 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.38 -41.49 80.5 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.768 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.757 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.2 mt -77.35 -39.37 27.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.094 -179.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.942 ' HB3' HD13 ' B' ' 597' ' ' LEU . 1.4 mm? -42.73 -59.26 2.0 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.65 ' HA ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -60.04 -30.89 69.49 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -178.798 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.405 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 0.4 OUTLIER -56.52 -23.76 41.88 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.019 HD13 HD11 ' A' ' 463' ' ' LEU . 55.9 mt -61.43 -47.49 85.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.756 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.567 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 58.78 59.41 5.6 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.598 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.567 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 77.3 Cg_endo -101.22 -159.32 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.356 0 C-N-CA 123.996 3.131 . . . . 0.0 111.555 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.77 139.87 52.5 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.724 178.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -79.64 133.94 36.42 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.411 0.624 . . . . 0.0 111.592 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 19.2 mtmt -156.3 159.86 39.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.569 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.409 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 0.1 OUTLIER -105.17 111.83 24.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.965 0.412 . . . . 0.0 111.656 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.494 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -90.79 110.92 22.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.976 178.995 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 58.73 42.87 19.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.818 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 509' ' ' ASP . . . . . 0.409 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 0.4 OUTLIER 74.58 12.76 3.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.353 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' A' ' 507' ' ' ILE . 0.0 OUTLIER -116.22 129.25 56.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.681 0.276 . . . . 0.0 110.94 179.851 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 2.9 tpt -62.13 108.57 1.09 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.013 0.435 . . . . 0.0 110.643 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.729 ' CD2' HG22 ' A' ' 469' ' ' THR . 10.8 m170 -122.64 126.98 48.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.137 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.72 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.08 123.75 48.5 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.902 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.707 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.4 OUTLIER -178.94 169.51 1.57 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.158 0.504 . . . . 0.0 112.062 -178.598 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.755 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.4 pt? -116.07 169.15 9.48 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.332 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.403 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -136.48 106.67 6.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.996 0.427 . . . . 0.0 111.429 179.706 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.704 ' HG2' HG22 ' A' ' 464' ' ' THR . 4.9 pt-20 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.151 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.82 0.343 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -64.38 81.0 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.965 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.598 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -90.09 48.99 1.64 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 120.99 0.424 . . . . 0.0 110.624 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.582 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 12.6 pt-20 -86.47 -47.75 9.01 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.331 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -53.7 -22.66 9.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.52 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -52.9 -45.7 67.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.017 0.437 . . . . 0.0 111.25 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.582 ' CE1' ' O ' ' B' ' 586' ' ' GLU . 3.9 p80 -80.03 -23.43 41.44 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.077 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.941 HD12 HD21 ' A' ' 474' ' ' LEU . 27.3 tp -68.05 -38.85 82.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.801 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.4 mt -85.88 -29.64 6.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.612 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.76 -43.23 80.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.786 -179.455 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.795 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -71.35 -18.16 62.39 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.081 0.467 . . . . 0.0 110.196 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.764 ' N ' HD13 ' B' ' 593' ' ' LEU . 2.4 pt-20 -63.03 -31.67 72.86 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.469 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.448 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 1.0 OUTLIER -76.95 -49.35 15.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.776 -179.364 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.629 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -54.8 -26.54 17.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.155 0.502 . . . . 0.0 110.83 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.95 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.8 tp -69.0 -83.36 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.92 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.66 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.2 m -141.35 30.72 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.027 0 CA-C-N 114.656 -1.157 . . . . 0.0 110.707 -177.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.448 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 54.2 mtp180 -138.33 52.45 1.83 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.28 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 31.5 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.104 179.938 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.898 0.38 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 5.1 m -68.52 -171.52 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.242 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -142.01 133.88 27.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.581 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.659 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.0 t -61.88 115.73 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.019 0.437 . . . . 0.0 110.905 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.549 ' O ' HG23 ' A' ' 459' ' ' VAL . 27.5 p -131.79 172.18 12.61 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.586 0.707 . . . . 0.0 112.575 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.621 ' HA ' HG23 ' A' ' 496' ' ' ILE . 17.0 mt-10 -69.04 -54.82 13.07 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.475 -1.239 . . . . 0.0 110.05 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.04 -27.07 7.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.46 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -75.91 -37.92 58.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.752 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.74 HG13 HD11 ' A' ' 473' ' ' LEU . 6.6 t -74.57 -40.81 48.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.863 0.364 . . . . 0.0 111.428 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.717 ' CD ' HD23 ' A' ' 500' ' ' LEU . 2.4 mmm-85 -54.43 -39.53 67.46 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.232 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -71.01 -26.66 63.22 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.761 179.48 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.516 ' HH ' ' HZ ' ' A' ' 477' ' ' PHE . 15.6 m-30 -67.59 -36.96 81.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.132 0.491 . . . . 0.0 109.918 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.028 HD11 HD22 ' A' ' 500' ' ' LEU . 0.6 OUTLIER -74.84 -58.53 3.23 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.082 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.679 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.42 -28.26 2.04 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-O 121.15 0.5 . . . . 0.0 110.398 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 37.7 mtt85 -85.36 -48.58 8.9 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.561 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.48 130.21 0.54 Allowed Pre-proline 0 CA--C 1.532 0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.984 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.505 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 11.2 Cg_endo -53.65 157.18 10.25 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.753 2.302 . . . . 0.0 112.576 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.664 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.95 172.24 16.0 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.405 0.622 . . . . 0.0 111.694 -179.415 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.891 HG22 ' O ' ' A' ' 511' ' ' MET . 35.1 p -103.73 160.69 14.56 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 177.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.557 ' CG2' HD21 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -54.52 -43.72 72.14 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.057 -0.657 . . . . 0.0 110.487 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.855 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -61.24 -59.12 5.8 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.797 178.871 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -56.85 -20.44 22.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.581 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.74 HD11 HG13 ' A' ' 459' ' ' VAL . 1.6 tt -87.87 -42.4 12.55 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.015 0.436 . . . . 0.0 111.446 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.959 ' HB3' HD23 ' A' ' 493' ' ' LEU . 2.0 pp -84.38 -48.04 10.08 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.144 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 32.6 mmtt -48.83 -29.84 5.08 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -179.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.446 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -68.52 -41.68 79.61 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.932 -179.841 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.659 ' CE2' HG22 ' A' ' 454' ' ' VAL . 11.5 m-85 -66.47 -30.04 70.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 111.021 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.65 113.84 1.8 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.8 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 3.1 m 74.1 3.28 4.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.392 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 1.1 tptt -63.44 -54.47 36.11 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.823 0.344 . . . . 0.0 110.896 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.28 -33.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.229 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 482' ' ' THR . . . . . . . . . . . . . 14.8 p -54.42 -18.49 4.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.147 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 64.88 17.39 62.96 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.599 -0.81 . . . . 0.0 111.857 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.911 ' CD2' HG11 ' A' ' 492' ' ' VAL . 1.6 tp -84.58 129.95 34.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.011 0.434 . . . . 0.0 111.088 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.33 151.29 0.37 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.66 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 m -59.96 -24.71 64.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.454 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -91.35 -45.78 8.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.553 179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.764 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.5 mt-30 -63.46 -41.32 98.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.077 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.497 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 85.6 m -50.32 -30.28 11.69 Favored 'General case' 0 C--N 1.334 -0.087 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.807 HG22 HD13 ' A' ' 474' ' ' LEU . 5.0 t -83.62 -39.85 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.989 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 491' ' ' ASN . . . . . 0.426 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 4.9 t30 -61.04 -31.17 70.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.907 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.911 HG11 ' CD2' ' A' ' 484' ' ' LEU . 4.0 p -97.1 -12.49 8.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.861 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.959 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.3 OUTLIER -91.06 -40.9 11.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.176 0.512 . . . . 0.0 110.024 179.409 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.696 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -50.28 -36.64 32.35 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.257 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.9 OUTLIER -66.9 -42.87 84.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.297 -179.607 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.621 HG23 ' HA ' ' A' ' 456' ' ' GLU . 7.1 mt -77.74 -43.79 29.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.468 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.95 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -36.05 -57.67 0.69 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.729 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.664 ' HA ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -62.52 -22.77 66.55 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.29 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.514 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 1.4 mmp_? -60.14 -19.88 55.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.937 0.399 . . . . 0.0 110.69 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.028 HD22 HD11 ' A' ' 463' ' ' LEU . 16.4 mt -64.46 -47.92 77.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.044 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.582 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 56.81 59.07 8.21 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.403 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.582 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 73.9 Cg_endo -101.09 -160.22 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 124.02 3.147 . . . . 0.0 111.669 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.76 141.03 49.83 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.681 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.53 134.82 36.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.291 0.567 . . . . 0.0 111.591 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 10.9 mtmt -156.08 160.2 39.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.608 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -103.41 109.96 21.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.977 0.418 . . . . 0.0 111.699 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.515 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.73 110.81 22.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.869 178.896 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 58.35 44.53 18.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.975 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.5 t0 72.83 11.8 5.31 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.478 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 507' ' ' ILE . 1.8 tpmt? -116.08 128.81 55.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.606 0.241 . . . . 0.0 110.701 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.891 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -62.86 108.63 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.953 0.406 . . . . 0.0 110.581 180.0 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.806 ' CD2' HG23 ' A' ' 469' ' ' THR . 10.4 m170 -122.56 129.47 51.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.825 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.596 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -108.91 123.47 49.13 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.775 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.764 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.5 OUTLIER -177.89 169.34 2.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.059 0.457 . . . . 0.0 111.959 -178.57 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.737 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.5 pt? -114.12 169.13 9.25 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.468 179.111 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.4 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -137.57 106.71 6.02 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.052 0.453 . . . . 0.0 111.499 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.679 ' HG2' HG22 ' A' ' 464' ' ' THR . 3.8 pt-20 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.171 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.847 0.356 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -60.24 99.99 0.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.887 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.595 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -90.1 48.97 1.63 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.976 0.417 . . . . 0.0 110.56 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.589 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 12.5 pt-20 -86.45 -46.98 9.71 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.415 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -53.66 -22.61 9.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.582 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -51.76 -47.15 64.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.033 0.444 . . . . 0.0 110.976 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.589 ' CE1' ' O ' ' B' ' 586' ' ' GLU . 4.6 p80 -80.13 -25.06 40.07 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.04 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.892 ' CD1' HD21 ' A' ' 474' ' ' LEU . 21.5 tp -58.94 -29.96 67.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.839 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 80.5 mt -85.86 -29.7 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.229 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.574 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.58 -38.13 88.64 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.799 -179.291 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.83 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.98 -17.9 54.6 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.153 0.502 . . . . 0.0 110.106 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.804 ' N ' HD13 ' B' ' 593' ' ' LEU . 1.1 pt-20 -61.8 -31.27 71.48 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.817 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.514 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 8.3 pt-20 -82.49 -47.13 12.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.406 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.687 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.1 pp -51.76 -26.74 7.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.018 0.437 . . . . 0.0 111.219 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.922 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.4 tp -68.47 -83.33 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.58 0.705 . . . . 0.0 111.516 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.674 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m -140.93 30.39 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.115 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.43 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.514 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 33.7 mtp85 -142.41 43.68 1.64 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.117 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.172 179.933 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.814 0.34 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.872 ' O ' HG23 ' A' ' 482' ' ' THR . 12.7 m -156.91 -168.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.895 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.529 ' HA ' HG22 ' A' ' 482' ' ' THR . 7.5 mp0 -54.47 122.09 9.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.824 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.553 HG22 ' CD2' ' A' ' 477' ' ' PHE . 4.6 t -63.9 115.94 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.707 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.724 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.6 p -131.58 159.65 37.6 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.552 0.692 . . . . 0.0 112.644 -179.097 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.654 ' HA ' HG23 ' A' ' 496' ' ' ILE . 19.8 mt-10 -54.73 -54.69 38.58 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.505 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.34 -28.35 42.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.924 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.416 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -80.22 -33.14 38.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.968 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.724 HG23 ' O ' ' A' ' 455' ' ' THR . 2.8 t -75.8 -36.04 32.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.768 0.318 . . . . 0.0 111.472 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.609 ' HD3' HD23 ' A' ' 500' ' ' LEU . 2.3 mmm-85 -57.46 -38.62 74.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.919 0.39 . . . . 0.0 110.088 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.453 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -70.31 -29.12 65.76 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.562 179.298 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.453 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 7.1 m-30 -64.83 -38.78 92.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.14 0.495 . . . . 0.0 109.813 179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.079 HD11 HD22 ' A' ' 500' ' ' LEU . 0.3 OUTLIER -73.97 -58.27 3.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.193 -179.63 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.764 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.89 -27.8 2.31 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 121.143 0.497 . . . . 0.0 110.478 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -87.57 -49.73 6.98 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.792 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.41 ' HA ' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -169.28 125.98 0.79 Allowed Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.138 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.551 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 9.2 Cg_endo -52.14 158.42 5.16 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.707 2.271 . . . . 0.0 112.878 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.681 ' CE ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -151.13 168.46 24.58 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-O 121.451 0.643 . . . . 0.0 111.968 -179.528 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.635 HG22 ' CD2' ' A' ' 512' ' ' HIS . 2.1 p -100.9 176.37 5.3 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 176.696 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.473 ' CG2' HD21 ' B' ' 593' ' ' LEU . 0.1 OUTLIER -71.04 -41.51 70.71 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 119.781 -0.767 . . . . 0.0 110.616 179.655 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.858 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -64.62 -49.69 70.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.669 178.659 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 472' ' ' ASP . . . . . 0.544 ' HA ' ' HD3' ' A' ' 475' ' ' LYS . 11.5 t70 -59.13 -40.1 84.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.247 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.69 HD11 ' CG1' ' A' ' 459' ' ' VAL . 1.0 OUTLIER -62.15 -41.27 98.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.096 0.474 . . . . 0.0 111.137 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.892 HD21 ' CD1' ' B' ' 590' ' ' LEU . 1.0 OUTLIER -84.46 -26.03 28.49 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.314 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.544 ' HD3' ' HA ' ' A' ' 472' ' ' ASP . 0.0 OUTLIER -54.85 -36.51 65.13 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.577 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.499 ' CE ' ' HA ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -81.38 -43.75 18.55 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.063 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.553 ' CD2' HG22 ' A' ' 454' ' ' VAL . 11.5 m-85 -65.98 -27.32 68.05 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.288 0.566 . . . . 0.0 109.857 178.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -64.02 113.77 3.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.128 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 72.85 3.36 4.67 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.119 179.534 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.43 -48.31 56.58 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.824 0.345 . . . . 0.0 111.369 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.1 tptp -179.43 -27.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.447 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.872 HG23 ' O ' ' A' ' 452' ' ' VAL . 0.0 OUTLIER -45.51 -26.2 0.54 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.844 0.354 . . . . 0.0 110.987 179.698 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 62.86 16.4 56.69 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.497 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.826 ' CD2' HG11 ' A' ' 492' ' ' VAL . 3.3 mp -95.47 129.67 42.55 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 121.004 0.431 . . . . 0.0 111.091 -179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -39.53 155.06 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.636 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 p -62.7 -20.39 64.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.463 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 487' ' ' GLU . . . . . 0.467 ' HA ' ' CE1' ' B' ' 589' ' ' HIS . 4.0 mt-10 -95.48 -39.95 9.72 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.748 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.624 ' O ' HG12 ' A' ' 492' ' ' VAL . 14.0 mt-30 -69.26 -43.76 73.29 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.568 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 90.1 m -49.18 -28.99 4.93 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 121.271 0.558 . . . . 0.0 109.839 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.622 HG22 HD22 ' A' ' 474' ' ' LEU . 17.4 t -84.28 -39.98 15.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.631 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 491' ' ' ASN . . . . . 0.46 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 9.4 t30 -60.99 -29.91 69.97 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.975 178.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.826 HG11 ' CD2' ' A' ' 484' ' ' LEU . 7.6 p -97.48 -13.14 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.938 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.834 HD23 ' HB3' ' A' ' 474' ' ' LEU . 5.6 tp -90.95 -43.76 9.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.129 0.49 . . . . 0.0 110.107 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.717 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -49.29 -33.87 14.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.543 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.9 OUTLIER -69.09 -43.19 75.0 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.877 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.654 HG23 ' HA ' ' A' ' 456' ' ' GLU . 6.4 mt -78.93 -32.43 15.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -178.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.922 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -46.05 -57.72 4.21 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.679 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.687 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.96 -29.19 68.25 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -178.26 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.553 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 4.0 mmm180 -58.29 -22.08 51.46 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.91 0.386 . . . . 0.0 110.681 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.079 HD22 HD11 ' A' ' 463' ' ' LEU . 65.2 mt -58.74 -47.62 83.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.529 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.615 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.1 t-20 56.48 57.45 9.02 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.507 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.615 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.9 Cg_endo -101.74 -163.26 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.44 0 C-N-CA 124.175 3.25 . . . . 0.0 111.843 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 503' ' ' GLU . . . . . 0.406 ' O ' ' CD ' ' A' ' 505' ' ' LYS . 0.1 OUTLIER -116.39 145.07 43.52 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.038 178.51 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -83.24 132.91 35.02 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.404 0.621 . . . . 0.0 111.985 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.406 ' CD ' ' O ' ' A' ' 503' ' ' GLU . 0.0 OUTLIER -150.32 159.67 44.29 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.455 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.461 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 0.0 OUTLIER -105.1 112.17 25.21 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.605 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.468 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.7 OUTLIER -90.89 110.92 22.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.025 179.237 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.7 t30 58.85 41.99 20.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.764 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 509' ' ' ASP . . . . . 0.461 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 1.3 t70 74.37 14.89 3.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.252 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' A' ' 506' ' ' MET . 0.0 OUTLIER -116.26 131.61 56.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 110.908 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.488 ' HA ' ' HE3' ' A' ' 511' ' ' MET . 3.7 tpt -62.54 108.4 1.13 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.93 0.395 . . . . 0.0 110.687 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.635 ' CD2' HG22 ' A' ' 469' ' ' THR . 10.4 m170 -122.84 128.81 50.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.408 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.639 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.73 123.36 48.02 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.701 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.813 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.6 OUTLIER 179.11 169.13 0.97 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.107 0.48 . . . . 0.0 111.985 -178.857 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.758 ' CD2' HD12 ' A' ' 463' ' ' LEU . 1.6 pt? -114.04 169.17 9.21 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.382 178.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -142.42 106.52 4.74 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.083 0.468 . . . . 0.0 111.382 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.764 ' HB2' HG22 ' A' ' 464' ' ' THR . 2.7 mm-40 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.847 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.864 0.364 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -60.48 86.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.917 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.666 HG21 ' O3P' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -90.07 49.37 1.7 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.95 0.405 . . . . 0.0 110.704 179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.584 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 3.1 pp20? -86.38 -40.54 15.31 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.836 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.37 -22.75 30.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.763 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -53.33 -55.21 26.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.011 0.434 . . . . 0.0 111.73 -179.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.677 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.6 p80 -77.08 -21.63 54.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.334 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 1.078 HD13 HD21 ' A' ' 474' ' ' LEU . 24.3 tp -60.6 -29.52 69.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.544 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 79.0 mt -85.75 -34.32 8.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.677 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.78 -40.89 68.93 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.359 -0.537 . . . . 0.0 112.161 -178.901 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.808 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -66.5 -18.54 65.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.103 0.478 . . . . 0.0 110.246 -179.762 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.771 ' HA ' HG21 ' A' ' 470' ' ' THR . 4.1 pt-20 -63.4 -30.87 71.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.597 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.737 ' OE1' HG23 ' B' ' 600' ' ' VAL . 0.5 OUTLIER -78.1 -47.97 17.08 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.126 -179.115 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.615 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.1 pp -52.33 -26.59 9.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.214 0.531 . . . . 0.0 110.89 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.913 HD22 ' HG ' ' A' ' 497' ' ' LEU . 13.1 tp -69.61 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.483 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.772 HG22 ' HG ' ' B' ' 597' ' ' LEU . 34.4 m -143.75 30.56 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.65 -178.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.463 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 54.6 mtp180 -137.23 38.96 2.51 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.221 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 600' ' ' VAL . . . . . 0.737 HG23 ' OE1' ' B' ' 595' ' ' GLU . 10.5 p . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.316 -0.85 . . . . 0.0 111.089 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 2.6 p30 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.861 0.363 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.912 HG13 ' CG2' ' A' ' 482' ' ' THR . 7.5 p -60.86 159.69 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.077 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.511 ' N ' HG22 ' A' ' 452' ' ' VAL . 0.0 OUTLIER -156.24 131.97 9.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.85 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.865 HG22 ' CD2' ' A' ' 477' ' ' PHE . 79.0 t -68.25 108.63 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.555 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.603 ' O ' HG23 ' A' ' 459' ' ' VAL . 23.4 p -131.52 157.78 42.66 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 121.556 0.693 . . . . 0.0 112.481 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.822 ' HA ' HG23 ' A' ' 496' ' ' ILE . 22.9 mt-10 -51.38 -53.36 37.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.475 -1.239 . . . . 0.0 110.941 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.71 -31.46 72.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.56 -179.151 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.437 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -71.37 -36.69 71.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.396 -179.439 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.798 ' HB ' HD21 ' A' ' 500' ' ' LEU . 16.4 t -72.31 -25.7 23.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.121 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.2 OUTLIER -63.11 -51.04 68.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.109 0.48 . . . . 0.0 109.814 178.769 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.485 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -54.93 -28.09 48.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 179.394 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.505 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 12.9 m-30 -68.81 -45.31 71.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.148 179.079 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.808 HD11 HD22 ' A' ' 500' ' ' LEU . 0.7 OUTLIER -68.47 -57.4 5.88 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.238 179.704 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.71 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.84 -24.51 1.47 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.789 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.572 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 24.4 ttp180 -93.35 -31.33 14.7 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.531 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.572 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER 169.89 162.7 0.2 Allowed Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.662 -179.588 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.681 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 73.9 Cg_endo -72.0 163.31 39.2 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.341 2.027 . . . . 0.0 113.34 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.751 ' SD ' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -152.15 152.64 32.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.383 -178.794 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.714 HG23 ' CE1' ' A' ' 512' ' ' HIS . 0.6 OUTLIER -95.9 162.4 13.59 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.021 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.771 HG21 ' HA ' ' B' ' 594' ' ' GLU . 1.8 p -65.3 -34.11 77.57 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.853 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.846 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -73.63 -50.91 18.73 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.35 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -59.73 -19.68 51.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.228 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.764 HD13 HD11 ' A' ' 497' ' ' LEU . 0.4 OUTLIER -75.24 -41.25 57.91 Favored 'General case' 0 C--O 1.23 0.051 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.133 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 1.078 HD21 HD13 ' B' ' 590' ' ' LEU . 1.3 pp -84.33 -46.53 11.66 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 37.4 mmtt -46.69 -29.23 1.78 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.773 0.32 . . . . 0.0 111.479 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.488 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -78.06 -41.24 36.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.642 179.547 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.865 ' CD2' HG22 ' A' ' 454' ' ' VAL . 16.5 m-85 -69.86 -67.71 0.47 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.298 0.57 . . . . 0.0 110.073 179.121 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 478' ' ' GLN . . . . . 0.436 ' CG ' ' O ' ' A' ' 477' ' ' PHE . 22.5 pt20 47.72 174.43 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.089 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 479' ' ' THR . . . . . 0.482 HG23 ' N ' ' A' ' 484' ' ' LEU . 0.2 OUTLIER -75.69 -1.55 25.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.534 -179.788 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 22.4 tptt -45.91 -29.62 1.46 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.608 0.242 . . . . 0.0 111.476 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.6 mmmt -149.21 -43.47 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.49 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.912 ' CG2' HG13 ' A' ' 452' ' ' VAL . 60.8 p -54.66 -17.2 3.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.051 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 63.82 18.27 61.69 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.19 -178.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.911 ' CD2' HG11 ' A' ' 492' ' ' VAL . 4.3 mp -108.13 122.16 46.32 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 120.961 0.41 . . . . 0.0 111.279 -179.396 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.26 156.72 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.729 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 486' ' ' SER . . . . . 0.4 ' O ' HG23 ' A' ' 490' ' ' VAL . 1.0 OUTLIER -62.26 -24.13 67.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.09 178.861 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -88.84 -48.35 7.54 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.577 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.701 ' O ' HG12 ' A' ' 492' ' ' VAL . 3.1 mt-30 -60.42 -43.25 96.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.997 179.438 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 92.7 m -49.43 -29.36 6.33 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 121.111 0.481 . . . . 0.0 109.785 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 1.012 HG22 HD22 ' A' ' 474' ' ' LEU . 8.2 t -83.55 -40.97 16.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.937 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 491' ' ' ASN . . . . . 0.411 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 3.3 t30 -60.96 -29.78 69.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.98 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.911 HG11 ' CD2' ' A' ' 484' ' ' LEU . 6.8 p -99.03 -6.97 9.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.823 179.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.704 ' CD1' HD22 ' A' ' 497' ' ' LEU . 9.6 tp -94.88 -34.58 12.38 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.003 0.43 . . . . 0.0 110.483 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.538 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -61.29 -37.02 81.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.109 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.463 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.5 OUTLIER -66.45 -45.27 80.34 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.849 -179.483 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.822 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.9 mt -73.93 -40.15 52.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.79 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.913 ' HG ' HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -38.82 -63.04 0.55 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.891 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.645 ' HA ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.5 -27.99 66.65 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -58.81 -21.06 55.44 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.083 0.468 . . . . 0.0 110.992 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.808 HD22 HD11 ' A' ' 463' ' ' LEU . 84.5 mt -61.67 -47.76 83.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.503 -179.318 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.59 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.9 t-20 60.95 57.67 3.59 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.04 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.59 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 58.5 Cg_endo -101.22 -160.63 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 124.291 3.327 . . . . 0.0 111.771 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.95 138.21 54.5 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.782 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.68 133.61 36.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.388 0.613 . . . . 0.0 111.719 -178.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -156.33 146.99 21.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.81 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.458 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 0.0 OUTLIER -89.22 111.26 22.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.94 0.4 . . . . 0.0 111.362 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.53 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.78 110.93 22.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.172 179.299 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 1.5 t30 60.06 41.85 16.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.906 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 509' ' ' ASP . . . . . 0.458 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 3.9 t0 74.22 13.82 3.87 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.223 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 506' ' ' MET . 0.0 OUTLIER -116.08 130.64 56.9 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.838 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.675 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -60.51 108.7 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 0.0 110.718 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.714 ' CE1' HG23 ' A' ' 469' ' ' THR . 19.4 m80 -122.58 155.75 35.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.673 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.746 ' CD1' HD21 ' B' ' 597' ' ' LEU . 5.3 p90 -134.29 123.69 24.62 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.757 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.681 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER 179.77 169.43 1.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.391 0.615 . . . . 0.0 112.03 -178.99 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.811 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -118.54 168.86 10.28 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.425 178.454 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.406 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -135.07 106.02 6.61 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.167 0.508 . . . . 0.0 111.165 179.369 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.71 ' HG2' HG22 ' A' ' 464' ' ' THR . 1.8 pt-20 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.023 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.813 0.34 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -60.36 91.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.892 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.839 ' O2P' HG22 ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 585' ' ' ASP . . . . . 0.409 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 17.0 t70 -90.07 49.36 1.7 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.015 0.436 . . . . 0.0 110.73 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.464 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 0.0 OUTLIER -86.41 -37.62 18.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.984 179.52 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.09 -22.87 31.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.784 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -52.72 -55.16 24.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.091 0.472 . . . . 0.0 111.56 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.464 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.0 OUTLIER -79.7 -21.89 44.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.181 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.87 ' CD1' HD21 ' A' ' 474' ' ' LEU . 28.2 tp -52.0 -39.81 60.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.043 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 54.5 mt -86.06 -29.71 6.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.134 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.559 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.57 -39.61 84.9 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.45 -179.781 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.804 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.52 -18.0 55.38 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.156 0.503 . . . . 0.0 109.92 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.75 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.4 OUTLIER -63.43 -30.76 71.84 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.974 179.709 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.65 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 6.5 pt-20 -80.73 -47.41 14.0 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.721 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.5 pp -50.15 -26.54 3.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.138 0.494 . . . . 0.0 110.991 179.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.972 HD13 ' HB3' ' A' ' 497' ' ' LEU . 11.9 tp -64.63 -83.77 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.307 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.74 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.8 m -136.09 31.2 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.147 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.188 -177.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.65 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 1.7 mtp-105 -136.8 108.14 6.86 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.161 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.2 p . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.135 179.994 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 6.8 p30 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.876 0.369 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.771 ' O ' HG22 ' A' ' 482' ' ' THR . 16.3 m -155.38 -166.41 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -137.11 132.9 34.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.821 0.344 . . . . 0.0 110.653 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.525 HG22 ' CE2' ' A' ' 477' ' ' PHE . 7.5 t -77.87 104.71 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.636 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.504 ' O ' HG23 ' A' ' 459' ' ' VAL . 23.2 p -132.02 164.29 26.52 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.539 0.685 . . . . 0.0 112.192 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.701 ' HA ' HG23 ' A' ' 496' ' ' ILE . 18.6 mt-10 -57.33 -53.47 57.79 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.506 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.99 -29.22 63.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.07 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.406 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -74.6 -35.06 62.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.644 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.754 ' CG1' HD21 ' A' ' 500' ' ' LEU . 14.2 t -76.02 -28.36 18.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 120.859 -0.337 . . . . 0.0 111.511 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -62.73 -50.82 69.57 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.98 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.46 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -55.43 -27.04 45.46 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.356 179.053 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.507 ' O ' ' O ' ' A' ' 466' ' ' LYS . 11.4 m-30 -68.38 -44.44 75.14 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.527 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.084 HD11 HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -70.58 -54.36 12.36 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.099 179.318 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.448 HG22 ' CG ' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.09 -24.65 1.17 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.673 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.606 ' O ' ' HG2' ' A' ' 466' ' ' LYS . 3.5 ptp85 -97.04 -47.84 5.63 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.336 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.689 ' HD3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -165.77 166.79 9.64 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 122.316 0.247 . . . . 0.0 110.708 179.905 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.689 ' HD2' ' HD3' ' A' ' 466' ' ' LYS . 97.0 Cg_endo -77.15 162.86 31.17 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.276 1.984 . . . . 0.0 113.551 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.706 ' SD ' HD11 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -156.14 151.16 26.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.168 -178.74 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.673 HG22 ' O ' ' A' ' 511' ' ' MET . 10.9 p -99.11 175.06 6.03 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.506 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.6 OUTLIER -71.31 -31.52 67.53 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.333 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.85 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -77.0 -53.52 7.72 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.325 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -57.89 -19.94 33.2 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.757 178.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.883 HD12 HD11 ' A' ' 497' ' ' LEU . 6.8 mt -77.27 -40.92 42.94 Favored 'General case' 0 C--O 1.23 0.054 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.895 HD22 HG22 ' A' ' 490' ' ' VAL . 1.6 pp -84.22 -47.37 10.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.562 ' N ' HD12 ' A' ' 474' ' ' LEU . 18.0 mmtp -46.85 -28.33 1.53 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.698 0.285 . . . . 0.0 111.484 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.52 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -79.56 -41.03 28.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.653 179.545 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.525 ' CE2' HG22 ' A' ' 454' ' ' VAL . 16.8 m-85 -69.9 -67.31 0.5 Allowed 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.529 0.681 . . . . 0.0 110.053 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 53.4 173.93 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.712 -1.131 . . . . 0.0 111.507 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 11.5 t -75.06 -21.14 59.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.133 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -17.12 34.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.438 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -113.68 -75.59 0.6 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.78 0.324 . . . . 0.0 111.836 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.771 HG22 ' O ' ' A' ' 452' ' ' VAL . 30.2 p -74.07 9.4 1.6 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.758 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 58.41 19.78 42.1 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.788 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.906 HD23 HG11 ' A' ' 492' ' ' VAL . 1.5 mp -105.46 122.88 46.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.919 0.39 . . . . 0.0 111.422 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.93 154.23 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.82 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 486' ' ' SER . . . . . 0.533 ' O ' HG23 ' A' ' 490' ' ' VAL . 74.2 m -61.15 -26.41 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.139 179.002 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -84.61 -53.28 5.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.443 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.581 ' O ' HG12 ' A' ' 492' ' ' VAL . 0.9 OUTLIER -59.66 -40.48 87.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.023 179.392 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 44.2 m -51.43 -31.06 21.62 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.895 HG22 HD22 ' A' ' 474' ' ' LEU . 2.5 t -78.86 -42.59 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.309 179.321 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.51 -34.05 72.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.897 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.906 HG11 HD23 ' A' ' 484' ' ' LEU . 7.3 p -93.7 -10.46 9.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.75 179.146 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.588 ' HG ' HD23 ' A' ' 497' ' ' LEU . 21.2 tp -90.24 -44.39 9.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.092 0.473 . . . . 0.0 110.554 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.716 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -51.61 -33.9 35.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.69 -179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -41.9 78.34 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.216 -179.093 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.701 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.5 mt -79.13 -29.95 14.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.972 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.3 OUTLIER -47.63 -58.35 4.38 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.489 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.721 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.42 -28.05 66.59 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -177.856 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.556 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.5 mmm180 -60.38 -20.84 61.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.057 0.456 . . . . 0.0 110.19 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.084 HD22 HD11 ' A' ' 463' ' ' LEU . 77.4 mt -59.59 -47.61 84.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.037 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.634 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 28.0 t-20 55.36 54.5 9.71 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.164 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.634 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 69.7 Cg_endo -101.25 -160.15 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 124.071 3.181 . . . . 0.0 111.596 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.19 140.44 50.19 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.834 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.7 133.57 36.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.316 0.579 . . . . 0.0 111.477 -178.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -156.36 132.11 9.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.989 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.18 108.86 13.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.876 0.369 . . . . 0.0 111.396 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.469 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.61 110.8 22.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.938 179.047 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 66.2 t30 59.64 43.9 15.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.857 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.6 t0 72.4 13.29 5.54 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.279 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.416 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.08 128.44 55.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.777 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.673 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -60.98 108.65 0.9 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.041 0.448 . . . . 0.0 110.519 179.838 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.547 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 24.7 m80 -122.8 132.82 54.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.211 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.639 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.0 OUTLIER -108.51 123.77 49.41 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.788 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.583 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER -171.82 169.69 5.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.556 0.693 . . . . 0.0 112.762 -178.735 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.817 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -129.19 168.92 15.46 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.341 178.401 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.44 105.78 7.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.064 0.459 . . . . 0.0 110.9 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.448 ' CG ' HG22 ' A' ' 464' ' ' THR . 39.3 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.918 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.886 0.374 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -60.34 87.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.575 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -90.12 49.78 1.76 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.019 0.438 . . . . 0.0 110.721 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.588 ' HA ' ' CE1' ' B' ' 589' ' ' HIS . 12.0 pt-20 -86.12 -35.2 20.33 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.816 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 587' ' ' ASP . . . . . 0.53 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.6 OUTLIER -84.06 -22.78 31.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.566 -179.351 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -53.45 -55.16 27.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.077 0.465 . . . . 0.0 111.561 -179.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.588 ' CE1' ' HA ' ' B' ' 586' ' ' GLU . 1.5 p80 -80.01 -21.81 43.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.235 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 1.021 ' CD1' HD21 ' A' ' 474' ' ' LEU . 39.1 tp -48.63 -29.54 4.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.299 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 591' ' ' ILE . . . . . 0.527 HG23 ' OE1' ' B' ' 594' ' ' GLU . 79.1 mt -85.61 -29.77 6.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.216 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.574 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.48 -52.13 65.77 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.15 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.806 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -66.51 -17.94 65.09 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.497 -179.612 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.527 ' OE1' HG23 ' B' ' 591' ' ' ILE . 1.0 OUTLIER -62.28 -30.87 71.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.968 -179.682 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.502 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 1.6 pt-20 -82.52 -43.73 16.79 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.591 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -53.86 -26.5 14.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.097 0.475 . . . . 0.0 111.172 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.909 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.6 tp -71.1 -82.65 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.557 0.694 . . . . 0.0 112.041 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.669 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.4 m -140.5 29.87 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.627 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.502 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 25.4 mtp180 -141.7 40.83 1.7 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.181 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 9.7 p . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.07 -179.992 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 33.1 p-10 . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.84 0.352 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.567 ' C ' HG22 ' A' ' 482' ' ' THR . 14.0 p -167.14 160.66 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.095 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.499 ' N ' HG22 ' A' ' 452' ' ' VAL . 4.0 mt-30 -41.72 131.4 3.15 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.877 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.789 HG22 ' CD2' ' A' ' 477' ' ' PHE . 59.3 t -90.42 116.89 32.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.648 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.446 ' O ' HG23 ' A' ' 459' ' ' VAL . 25.4 p -131.65 163.36 28.28 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.642 0.734 . . . . 0.0 112.503 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.787 ' HA ' HG23 ' A' ' 496' ' ' ILE . 22.3 mt-10 -58.56 -52.57 65.1 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.51 -1.223 . . . . 0.0 110.933 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.03 -27.49 68.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.581 -178.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.474 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -70.07 -58.18 4.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.738 0.304 . . . . 0.0 111.62 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.918 ' HB ' HD21 ' A' ' 500' ' ' LEU . 16.9 t -48.17 -31.72 3.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.946 0.403 . . . . 0.0 110.9 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.572 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -54.69 -47.99 72.98 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.259 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -63.35 -27.88 69.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.507 179.452 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.512 ' CE2' ' CE2' ' A' ' 477' ' ' PHE . 8.2 m-30 -68.78 -42.9 76.76 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.289 0.566 . . . . 0.0 109.649 178.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.089 HD11 HD13 ' A' ' 500' ' ' LEU . 3.7 mt -70.35 -60.29 2.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.964 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.661 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.1 OUTLIER -49.44 -24.43 1.99 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.065 -179.569 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -92.93 -46.04 7.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.508 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.489 ' HD2' ' HD2' ' A' ' 467' ' ' PRO . 1.4 mmmt -165.2 128.8 1.67 Allowed Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.005 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.564 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 18.0 Cg_endo -56.17 146.09 72.85 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.358 2.039 . . . . 0.0 112.716 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.629 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -132.78 178.23 7.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.278 -179.276 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.571 HG22 ' O ' ' A' ' 511' ' ' MET . 10.1 p -124.16 160.71 27.24 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.094 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.586 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.7 OUTLIER -58.22 -30.84 66.82 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.192 -0.603 . . . . 0.0 111.251 -179.174 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 1.012 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -76.53 -50.84 12.93 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.823 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 472' ' ' ASP . . . . . 0.432 ' HA ' ' CD ' ' A' ' 475' ' ' LYS . 11.9 t70 -64.79 -31.04 72.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.86 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.767 HD13 HD11 ' A' ' 493' ' ' LEU . 0.5 OUTLIER -60.13 -42.36 94.62 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.164 0.507 . . . . 0.0 110.985 -179.558 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 1.021 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.9 pp -85.24 -25.03 27.53 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.555 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.477 ' HD2' ' O ' ' A' ' 471' ' ' LYS . 4.1 mttt -46.05 -36.32 5.62 Favored 'General case' 0 N--CA 1.461 0.109 0 N-CA-C 111.628 0.232 . . . . 0.0 111.628 -178.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.527 ' HE3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -93.43 -43.23 8.85 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.135 179.573 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.789 ' CD2' HG22 ' A' ' 454' ' ' VAL . 3.0 m-85 -59.35 -30.42 68.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.381 0.61 . . . . 0.0 110.158 179.017 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 478' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -72.17 113.79 9.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.908 -179.81 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 97.8 m -164.89 -76.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.891 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp 177.6 -34.15 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.177 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.75 -47.15 59.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.459 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.567 HG22 ' C ' ' A' ' 452' ' ' VAL . 75.9 p -60.66 -11.96 8.89 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.004 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 58.3 21.89 49.01 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 120.337 -0.935 . . . . 0.0 110.827 -178.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 1.004 HD23 HG11 ' A' ' 492' ' ' VAL . 0.2 OUTLIER -114.87 119.62 37.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.191 -0.505 . . . . 0.0 111.407 -179.054 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.51 161.09 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.496 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 98.9 p -60.89 -24.98 66.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.021 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -91.02 -43.51 9.89 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.349 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.663 ' O ' HG12 ' A' ' 492' ' ' VAL . 2.0 mt-30 -64.08 -41.24 97.39 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.918 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 91.8 m -51.75 -27.7 12.9 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.714 178.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.783 HG22 HD22 ' A' ' 474' ' ' LEU . 6.6 t -84.94 -40.37 14.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.813 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -61.09 -32.0 71.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.911 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 1.004 HG11 HD23 ' A' ' 484' ' ' LEU . 7.7 p -94.01 -11.15 9.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.752 179.227 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.767 HD11 HD13 ' A' ' 473' ' ' LEU . 21.8 tp -89.85 -43.04 10.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.216 0.531 . . . . 0.0 110.204 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.573 ' HB2' ' HB2' ' B' ' 593' ' ' LEU . . . -51.97 -33.54 38.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.658 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.23 -42.88 79.11 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.891 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.787 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.9 mt -72.86 -45.28 56.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -178.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.909 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.7 OUTLIER -37.38 -64.01 0.4 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.6 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.591 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.61 -27.06 65.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.991 0.424 . . . . 0.0 111.261 -179.282 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.71 -26.5 68.7 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.547 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.089 HD13 HD11 ' A' ' 463' ' ' LEU . 67.3 mt -60.36 -47.37 86.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.918 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.56 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 59.12 59.69 5.13 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.732 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.56 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 91.7 Cg_endo -101.19 -159.25 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.326 0 C-N-CA 124.04 3.16 . . . . 0.0 111.317 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.39 141.53 48.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.738 178.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -79.47 134.23 36.53 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.321 0.581 . . . . 0.0 111.292 -179.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -156.12 157.95 36.87 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.857 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.441 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.8 OUTLIER -105.19 109.94 22.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.93 0.395 . . . . 0.0 111.532 -179.757 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.488 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.72 110.79 22.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.867 178.994 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 59.51 44.41 14.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.739 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 6.5 t0 71.16 13.83 6.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.257 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.45 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.15 134.69 54.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.784 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.571 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -65.78 108.74 2.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.937 0.399 . . . . 0.0 110.88 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.508 ' CE1' ' CG2' ' A' ' 469' ' ' THR . 25.6 m80 -123.05 130.7 53.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.093 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.63 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -105.0 125.44 50.98 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.092 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.564 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER -175.29 169.33 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.78 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.703 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.2 pt? -122.74 169.14 11.38 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.062 178.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.79 106.75 8.31 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.434 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.661 ' HG2' HG22 ' A' ' 464' ' ' THR . 6.1 pt-20 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.044 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.844 0.354 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -60.69 86.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.926 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.585 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -90.2 49.13 1.65 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.022 0.439 . . . . 0.0 110.598 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.554 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 12.2 pt-20 -86.52 -47.31 9.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.357 179.029 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 587' ' ' ASP . . . . . 0.412 ' O ' ' HB3' ' B' ' 590' ' ' LEU . 1.1 p30 -53.53 -22.46 8.27 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.554 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -57.51 -40.8 79.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.899 0.381 . . . . 0.0 111.413 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.554 ' CE1' ' O ' ' B' ' 586' ' ' GLU . 2.8 p80 -80.32 -21.87 42.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.724 -179.629 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.938 ' CD1' HD21 ' A' ' 474' ' ' LEU . 16.6 tp -53.5 -31.05 44.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.957 0.408 . . . . 0.0 110.72 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.7 mt -85.76 -29.59 6.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.892 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.578 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.42 -38.74 92.1 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.809 -179.441 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.824 HD13 ' N ' ' B' ' 594' ' ' GLU . 0.0 OUTLIER -78.39 -18.0 55.65 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.191 0.52 . . . . 0.0 109.988 -179.887 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.824 ' N ' HD13 ' B' ' 593' ' ' LEU . 1.1 pt-20 -62.37 -30.75 71.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.844 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.585 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 7.5 pt-20 -82.2 -48.49 11.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.316 -179.101 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.734 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -52.39 -26.8 9.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.22 0.533 . . . . 0.0 111.211 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.994 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.8 tp -60.87 -84.86 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.343 -0.844 . . . . 0.0 113.027 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.739 HG13 ' HG ' ' B' ' 597' ' ' LEU . 34.8 m -131.74 39.85 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.156 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.679 -177.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.585 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 39.6 mtp180 -129.45 100.34 5.52 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.2 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.072 179.99 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.86 0.362 . . . . 0.0 111.226 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.817 HG13 ' CG2' ' A' ' 482' ' ' THR . 7.6 p -169.51 160.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.045 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.519 ' N ' HG22 ' A' ' 452' ' ' VAL . 0.9 OUTLIER -156.1 132.26 9.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.896 -179.891 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.866 HG22 ' CD2' ' A' ' 477' ' ' PHE . 93.1 t -66.45 111.85 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.349 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.564 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.473 ' O ' HG23 ' A' ' 459' ' ' VAL . 23.6 p -131.49 163.66 27.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.634 0.73 . . . . 0.0 112.361 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.809 ' HA ' HG23 ' A' ' 496' ' ' ILE . 21.7 mt-10 -57.99 -53.08 62.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.67 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.49 -28.09 68.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.0 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -67.51 -58.07 5.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.828 0.346 . . . . 0.0 111.36 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.86 ' HB ' HD21 ' A' ' 500' ' ' LEU . 21.2 t -50.58 -28.83 6.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.581 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.508 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.9 OUTLIER -58.5 -45.49 88.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.978 0.418 . . . . 0.0 110.434 179.036 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.439 ' HG2' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -60.87 -25.38 66.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.929 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.525 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 8.8 m-30 -77.83 -39.74 42.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.832 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.827 HD11 HD22 ' A' ' 500' ' ' LEU . 0.9 OUTLIER -70.08 -61.4 1.79 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.233 179.914 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.751 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.1 OUTLIER -48.37 -27.27 2.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.093 0.473 . . . . 0.0 110.563 179.783 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 45.1 ttp180 -87.1 -50.32 6.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.907 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.419 ' HD2' ' HD2' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -167.46 128.28 1.18 Allowed Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.612 -179.839 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.621 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 9.0 Cg_endo -48.78 169.7 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.234 1.956 . . . . 0.0 112.502 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.523 ' SD ' HD22 ' A' ' 463' ' ' LEU . 0.0 OUTLIER -156.42 -178.55 7.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.601 0.715 . . . . 0.0 111.88 -178.801 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 469' ' ' THR . . . . . 1.016 HG23 ' CD2' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -119.84 170.61 9.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.59 -1.186 . . . . 0.0 107.818 177.744 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.509 HG23 HD22 ' B' ' 597' ' ' LEU . 0.6 OUTLIER -71.15 -32.86 69.47 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.074 -0.65 . . . . 0.0 110.612 179.682 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.785 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -76.86 -46.66 23.79 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.461 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -64.25 -20.53 66.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.534 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.758 HD12 HD11 ' A' ' 497' ' ' LEU . 4.8 mt -78.39 -37.23 44.53 Favored 'General case' 0 C--N 1.334 -0.081 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.998 HD22 HG22 ' A' ' 490' ' ' VAL . 1.4 pp -82.46 -49.51 9.86 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.132 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.616 ' N ' HD12 ' A' ' 474' ' ' LEU . 16.1 mmtp -46.72 -28.84 1.64 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -75.76 -43.0 48.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.921 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.866 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.5 m-85 -66.79 -65.56 0.66 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.475 0.655 . . . . 0.0 110.294 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 53.6 174.22 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.455 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 479' ' ' THR . . . . . 0.484 HG23 ' N ' ' A' ' 484' ' ' LEU . 0.6 OUTLIER -79.48 3.03 19.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.545 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -45.74 -39.8 8.61 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.697 0.284 . . . . 0.0 111.533 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 481' ' ' LYS . . . . . 0.633 ' HB2' HG12 ' A' ' 452' ' ' VAL . 8.7 mmtt -141.09 -43.15 0.38 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.493 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.817 ' CG2' HG13 ' A' ' 452' ' ' VAL . 60.2 p -53.77 -17.64 2.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.221 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.431 ' C ' HG23 ' A' ' 479' ' ' THR . . . 65.99 19.22 67.59 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.479 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 1.005 HD23 HG11 ' A' ' 492' ' ' VAL . 0.2 OUTLIER -108.49 120.62 42.96 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.953 0.406 . . . . 0.0 111.096 -179.573 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.12 160.82 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.532 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 486' ' ' SER . . . . . 0.412 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.2 OUTLIER -59.85 -23.93 63.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.162 0.506 . . . . 0.0 109.741 178.558 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -89.77 -51.4 5.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.167 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.721 ' O ' HG12 ' A' ' 492' ' ' VAL . 5.6 mt-30 -59.06 -41.68 88.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.019 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 91.9 m -50.61 -30.5 13.5 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.715 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.998 HG22 HD22 ' A' ' 474' ' ' LEU . 3.4 t -82.57 -40.59 16.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.184 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -60.37 -30.74 69.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.962 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 1.005 HG11 HD23 ' A' ' 484' ' ' LEU . 5.6 p -99.01 -6.94 9.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.835 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.781 HD11 HD22 ' A' ' 497' ' ' LEU . 13.8 tp -94.29 -40.79 9.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.032 0.444 . . . . 0.0 110.557 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.693 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -54.67 -38.02 66.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.442 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -41.92 95.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.935 -179.286 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.809 HG23 ' HA ' ' A' ' 456' ' ' GLU . 13.7 mt -77.75 -48.17 24.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.994 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -31.58 -64.05 0.16 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.487 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.734 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -60.18 -29.82 68.95 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.415 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -55.52 -23.3 25.57 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.971 0.415 . . . . 0.0 111.036 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.86 HD21 ' HB ' ' A' ' 459' ' ' VAL . 16.0 mt -63.1 -47.45 82.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.654 -179.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.558 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 60.68 59.83 3.65 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.013 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.558 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 53.1 Cg_endo -99.78 -159.24 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 123.983 3.122 . . . . 0.0 111.6 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.55 140.19 51.83 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.828 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.59 134.89 36.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.369 0.604 . . . . 0.0 111.713 -178.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -156.22 160.08 39.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.588 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.56 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 8.6 ptm -97.79 109.95 22.61 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.137 0.494 . . . . 0.0 111.589 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.552 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.3 OUTLIER -90.63 110.92 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.852 179.103 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.37 38.77 19.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.719 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 509' ' ' ASP . . . . . 0.56 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 5.2 t70 77.86 10.15 2.21 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.573 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.447 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.24 134.23 55.14 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.619 0.247 . . . . 0.0 111.088 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.459 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.04 108.61 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.098 0.475 . . . . 0.0 111.004 -179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 1.016 ' CD2' HG23 ' A' ' 469' ' ' THR . 6.4 m170 -122.62 148.37 45.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.436 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.628 ' CZ ' HD23 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -126.1 123.31 38.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.245 179.666 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.769 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.3 OUTLIER -176.68 169.3 2.54 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.142 0.496 . . . . 0.0 111.945 -179.129 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.765 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.6 pt? -114.24 169.15 9.24 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.404 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.419 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -142.35 106.43 4.74 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.029 0.443 . . . . 0.0 111.378 179.683 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.751 ' HB2' HG22 ' A' ' 464' ' ' THR . 28.6 mm-40 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.826 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.768 0.318 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -63.13 82.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.935 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.61 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -90.23 49.13 1.65 Allowed 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 120.992 0.425 . . . . 0.0 110.651 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.583 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 3.0 pp20? -86.45 -45.39 11.19 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.421 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -53.73 -22.76 9.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.539 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.87 -47.28 64.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.962 0.411 . . . . 0.0 111.376 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.583 ' CE1' ' O ' ' B' ' 586' ' ' GLU . 3.4 p80 -80.07 -21.85 42.93 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.238 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.907 ' CD1' HD21 ' A' ' 474' ' ' LEU . 26.1 tp -62.95 -43.61 98.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.793 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 591' ' ' ILE . . . . . 0.408 ' O ' ' HB3' ' B' ' 594' ' ' GLU . 51.3 mt -86.13 -29.55 6.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 120.813 0.34 . . . . 0.0 111.009 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.567 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -63.28 -44.97 93.55 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.643 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 1.039 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -69.69 -19.72 63.57 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.38 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.721 ' N ' HD13 ' B' ' 593' ' ' LEU . 10.6 tt0 -63.13 -30.86 71.93 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.337 179.298 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.425 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.3 OUTLIER -72.32 -44.45 62.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.495 -179.492 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 1.05 HD11 ' HB1' ' A' ' 494' ' ' ALA . 4.8 pt -58.17 -26.64 30.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.184 0.516 . . . . 0.0 110.963 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.825 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.0 tp -72.73 -81.78 0.05 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.04 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.708 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.0 m -141.14 30.28 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.054 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.731 -177.649 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.425 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 7.9 mtp180 -138.93 38.8 2.16 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.368 -179.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 30.2 m . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.111 -179.956 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.741 0.305 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.815 ' HB ' HG22 ' A' ' 482' ' ' THR . 21.8 t -61.88 144.13 14.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.099 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.13 133.4 44.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.775 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.468 HG22 ' CE2' ' A' ' 477' ' ' PHE . 0.9 OUTLIER -84.33 114.88 25.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.796 179.903 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.559 ' O ' HG23 ' A' ' 459' ' ' VAL . 27.4 p -131.65 169.87 15.55 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.557 0.694 . . . . 0.0 112.654 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.596 ' HA ' HG23 ' A' ' 496' ' ' ILE . 20.6 mt-10 -69.13 -54.7 13.59 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.271 179.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.96 -26.76 6.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.758 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.431 ' O ' ' CD1' ' A' ' 462' ' ' TYR . . . -77.16 -35.54 55.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.85 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.779 HG13 HD11 ' A' ' 473' ' ' LEU . 4.0 t -76.1 -40.15 36.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.876 0.37 . . . . 0.0 111.392 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.571 ' CD ' HD23 ' A' ' 500' ' ' LEU . 1.6 mmm180 -53.99 -39.24 65.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.254 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.449 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -70.8 -28.83 64.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.614 179.334 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.449 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 14.2 m-30 -65.69 -36.95 85.1 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.084 HD11 HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -74.27 -55.96 5.44 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.838 179.718 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.815 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -50.48 -25.36 3.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.679 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 466' ' ' LYS . 24.6 ptt180 -92.99 -39.45 11.1 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.223 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -176.73 132.24 0.38 Allowed Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 120.72 0.295 . . . . 0.0 111.044 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.585 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 18.0 Cg_endo -58.06 152.47 51.48 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.752 2.301 . . . . 0.0 113.41 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.843 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.09 161.36 42.51 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.507 -179.505 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.765 HG22 ' O ' ' A' ' 511' ' ' MET . 11.6 p -96.62 -178.41 4.25 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.391 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 470' ' ' THR . . . . . 1.039 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -71.06 -44.71 65.2 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.687 -0.805 . . . . 0.0 110.88 179.593 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.823 ' HB3' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -62.32 -51.88 65.88 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.995 179.284 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 472' ' ' ASP . . . . . 0.413 ' H ' ' HG2' ' A' ' 471' ' ' LYS . 36.4 t70 -57.85 -26.71 62.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.388 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.843 HD12 ' CG ' ' A' ' 468' ' ' MET . 1.0 OUTLIER -83.05 -41.52 18.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.104 0.478 . . . . 0.0 111.37 -179.654 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.975 ' HB3' HD23 ' A' ' 493' ' ' LEU . 2.6 pp -83.98 -25.94 29.62 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -178.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.491 ' HD2' ' HB2' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -48.24 -33.59 8.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.685 0.279 . . . . 0.0 111.607 -178.986 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.482 ' HE2' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -87.5 -43.11 12.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.41 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.482 ' CD2' ' HE2' ' A' ' 476' ' ' LYS . 3.8 m-85 -61.15 -12.46 12.65 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.44 174.09 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.11 0.481 . . . . 0.0 111.738 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 479' ' ' THR . . . . . 0.431 HG23 ' C ' ' A' ' 483' ' ' GLY . 1.1 m -53.12 -17.27 1.49 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.88 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -37.6 -32.93 0.06 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 112.141 0.422 . . . . 0.0 112.141 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.2 -55.0 0.31 Allowed 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.815 HG22 ' HB ' ' A' ' 452' ' ' VAL . 17.0 p -56.78 -12.82 2.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.35 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.431 ' C ' HG23 ' A' ' 479' ' ' THR . . . 68.62 17.68 71.2 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.514 -0.85 . . . . 0.0 111.587 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.401 ' HB3' ' OG1' ' A' ' 489' ' ' THR . 0.4 OUTLIER -104.57 123.21 47.13 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 120.857 0.361 . . . . 0.0 111.058 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.42 150.83 0.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.916 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 486' ' ' SER . . . . . 0.479 ' O ' HG23 ' A' ' 490' ' ' VAL . 6.3 t -61.43 -23.09 65.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.373 179.233 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -90.94 -48.44 7.0 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.598 179.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -45.18 94.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.257 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 91.1 m -49.56 -35.37 20.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.132 179.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.694 HG13 HD22 ' A' ' 474' ' ' LEU . 2.2 t -75.75 -44.1 39.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.078 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.15 -26.2 49.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.082 179.095 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.404 ' O ' ' HG3' ' A' ' 495' ' ' GLN . 8.7 p -102.17 -15.29 7.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.085 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.975 HD23 ' HB3' ' A' ' 474' ' ' LEU . 1.8 tp -89.04 -42.52 11.7 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.106 0.479 . . . . 0.0 110.823 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 1.05 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -51.29 -37.12 45.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.604 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.33 -37.88 89.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.668 -179.506 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.596 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.0 mt -78.73 -42.52 25.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.825 ' HB3' HD13 ' B' ' 597' ' ' LEU . 3.2 mm? -41.83 -50.4 4.39 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.832 ' NZ ' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -61.18 -25.62 67.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.834 0.349 . . . . 0.0 111.593 -179.157 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.484 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 9.1 mmp_? -64.16 -19.04 65.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.969 0.414 . . . . 0.0 110.478 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.084 HD22 HD11 ' A' ' 463' ' ' LEU . 64.8 mt -62.13 -47.48 84.4 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.839 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.614 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.3 t-20 54.66 57.08 11.95 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.334 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.614 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 83.1 Cg_endo -102.24 -159.75 0.04 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.454 0 C-N-CA 123.967 3.111 . . . . 0.0 111.672 -179.251 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.05 140.44 51.0 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.659 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 504' ' ' ARG . . . . . 0.447 ' HB2' ' HE1' ' A' ' 511' ' ' MET . 35.4 ptt85 -79.52 134.59 36.5 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.342 0.591 . . . . 0.0 111.435 -178.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt -156.02 160.26 39.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.757 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.492 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 8.3 ptm -103.72 110.23 22.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.941 0.4 . . . . 0.0 111.555 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.543 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.68 110.88 22.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.882 179.011 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 56.0 t30 59.7 40.52 19.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.685 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 509' ' ' ASP . . . . . 0.492 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 0.6 OUTLIER 75.7 12.54 3.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.373 -180.0 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.425 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.18 131.76 56.85 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.619 0.247 . . . . 0.0 111.003 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.765 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -61.67 108.7 1.03 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.057 0.456 . . . . 0.0 110.69 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.588 ' CE1' HG23 ' A' ' 469' ' ' THR . 9.1 m80 -122.6 131.4 53.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.063 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.659 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.1 OUTLIER -109.81 123.75 50.1 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.848 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.616 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.5 OUTLIER -179.23 169.11 1.5 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.22 0.533 . . . . 0.0 112.236 -178.858 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.705 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.4 pt? -119.33 169.23 10.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.44 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.423 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -139.26 106.3 5.45 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.987 0.422 . . . . 0.0 111.264 179.541 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.815 ' HB2' HG22 ' A' ' 464' ' ' THR . 4.4 mm-40 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.769 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.855 0.359 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -61.8 84.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.581 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 12.4 p30 -85.26 49.62 1.79 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 120.855 0.36 . . . . 0.0 111.059 179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.591 ' HA ' ' CE1' ' B' ' 589' ' ' HIS . 2.5 pp20? -85.9 -36.68 19.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.301 0.572 . . . . 0.0 110.514 179.345 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 587' ' ' ASP . . . . . 0.648 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.5 OUTLIER -84.25 -22.65 30.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.459 -179.572 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -53.8 -55.14 29.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.09 0.472 . . . . 0.0 111.367 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.591 ' CE1' ' HA ' ' B' ' 586' ' ' GLU . 1.5 p80 -80.15 -21.88 42.62 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.224 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.911 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.7 tp -48.33 -33.79 9.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.128 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 68.4 mt -85.89 -29.65 6.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.86 0.362 . . . . 0.0 110.512 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.55 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -63.7 -40.38 96.65 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.15 179.906 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.811 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -80.16 -18.15 50.51 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.267 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.683 ' N ' HD13 ' B' ' 593' ' ' LEU . 71.0 tt0 -63.06 -30.91 71.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.863 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.507 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 9.6 pt-20 -80.63 -48.06 13.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.164 -179.389 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.677 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -52.2 -26.63 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.168 0.508 . . . . 0.0 110.893 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.923 HD22 ' HG ' ' A' ' 497' ' ' LEU . 13.4 tp -69.53 -82.65 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.936 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.684 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 30.8 m -140.47 29.27 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.319 -177.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.507 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.5 OUTLIER -143.25 39.24 1.43 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.241 -179.526 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.318 -0.848 . . . . 0.0 111.101 179.978 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.859 0.361 . . . . 0.0 111.277 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.768 ' O ' HG22 ' A' ' 482' ' ' THR . 7.3 p -62.83 124.99 18.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.111 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.97 134.14 43.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.744 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.842 HG22 ' CE2' ' A' ' 477' ' ' PHE . 1.4 t -66.37 115.9 4.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.955 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.579 ' O ' HG23 ' A' ' 459' ' ' VAL . 33.1 p -131.56 169.12 16.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.609 0.718 . . . . 0.0 112.537 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.698 ' HA ' HG23 ' A' ' 496' ' ' ILE . 26.6 mt-10 -69.24 -53.49 19.6 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.591 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.66 -27.87 59.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.158 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -73.98 -32.36 63.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.589 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.773 ' HB ' HD21 ' A' ' 500' ' ' LEU . 10.2 t -76.02 -36.72 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.864 0.364 . . . . 0.0 111.091 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.625 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -54.9 -46.05 74.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.123 179.106 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.441 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.2 OUTLIER -64.25 -26.15 68.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.793 179.486 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.532 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 18.0 m-30 -72.02 -36.31 69.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.141 179.243 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.862 HD11 HD22 ' A' ' 500' ' ' LEU . 1.3 mt -75.33 -59.39 2.77 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.186 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.538 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -46.11 -27.41 0.95 Allowed 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.555 179.827 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -85.77 -52.85 5.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.784 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.451 ' HG3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -167.57 135.4 1.96 Allowed Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.575 -179.756 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.574 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 33.2 Cg_exo -53.74 176.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.014 1.809 . . . . 0.0 113.02 -179.19 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.99 ' HG2' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -164.73 171.76 13.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.878 -177.439 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.66 HG22 ' CD2' ' A' ' 512' ' ' HIS . 1.4 p -112.21 157.95 20.28 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 177.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.608 HG23 HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.17 -39.98 84.18 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.24 -0.584 . . . . 0.0 110.569 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.843 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -65.74 -50.91 63.07 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.765 178.942 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -62.9 -22.21 66.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.418 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.99 HD21 ' HG2' ' A' ' 468' ' ' MET . 10.7 mt -76.65 -46.26 26.56 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.911 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.5 OUTLIER -73.27 -50.7 20.82 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.761 0.315 . . . . 0.0 111.199 -179.169 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.664 ' HD3' HD12 ' A' ' 474' ' ' LEU . 23.8 mmtt -52.11 -25.19 8.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.185 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.632 ' HE2' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -70.47 -43.99 68.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.853 0.358 . . . . 0.0 110.499 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.842 ' CE2' HG22 ' A' ' 454' ' ' VAL . 15.5 m-85 -69.95 -55.22 10.23 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.867 0.842 . . . . 0.0 109.874 179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 50.61 174.44 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.011 -1.45 . . . . 0.0 111.452 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 479' ' ' THR . . . . . 0.431 HG23 ' N ' ' A' ' 484' ' ' LEU . 1.2 m -80.79 3.11 23.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.315 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 20.4 tptt -48.46 -44.07 35.18 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.574 0.226 . . . . 0.0 111.577 -179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.6 -45.94 0.89 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.648 0.261 . . . . 0.0 111.521 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.768 HG22 ' O ' ' A' ' 452' ' ' VAL . 13.9 p -53.92 -16.51 1.88 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.161 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 61.84 20.4 59.77 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.453 -0.88 . . . . 0.0 111.131 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 1.066 HD23 HG11 ' A' ' 492' ' ' VAL . 0.3 OUTLIER -105.59 121.93 44.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 120.996 0.427 . . . . 0.0 111.366 -179.32 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.13 161.13 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.589 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 23.4 p -60.18 -25.15 65.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.077 0.465 . . . . 0.0 109.951 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -90.45 -46.3 8.43 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.422 179.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.665 ' O ' HG12 ' A' ' 492' ' ' VAL . 5.3 mt-30 -62.21 -41.95 98.84 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.889 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 88.6 m -50.76 -29.31 11.15 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.547 HG13 HD22 ' A' ' 474' ' ' LEU . 3.2 t -83.93 -41.14 16.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.293 179.264 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.58 -28.21 65.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.321 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 1.066 HG11 HD23 ' A' ' 484' ' ' LEU . 4.4 p -101.58 -7.57 9.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.957 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.786 HD23 ' HB3' ' A' ' 474' ' ' LEU . 3.4 tp -95.11 -35.89 11.72 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.943 0.402 . . . . 0.0 110.784 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.607 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -58.92 -38.99 80.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.175 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -41.6 88.02 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.825 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.698 HG23 ' HA ' ' A' ' 456' ' ' GLU . 12.7 mt -81.05 -30.07 11.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.351 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.923 ' HG ' HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -49.36 -56.93 7.91 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -178.622 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.677 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -61.86 -28.94 69.85 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -177.89 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.522 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 16.7 mmm180 -55.05 -22.16 14.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.059 0.457 . . . . 0.0 110.714 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.862 HD22 HD11 ' A' ' 463' ' ' LEU . 50.0 mt -63.15 -48.01 80.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.291 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.597 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.9 t-20 55.18 57.36 11.04 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.898 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.597 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 58.2 Cg_endo -100.36 -160.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.222 0 C-N-CA 124.083 3.189 . . . . 0.0 111.66 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.47 140.33 51.57 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.705 178.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -79.55 135.69 36.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.377 0.608 . . . . 0.0 111.535 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -154.69 147.46 24.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.747 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.44 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 6.9 ptm -90.14 108.77 19.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.011 0.434 . . . . 0.0 111.77 -179.6 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.436 ' N ' ' O ' ' A' ' 510' ' ' LYS . 0.6 OUTLIER -92.7 110.77 23.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.884 178.872 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 59.63 40.39 20.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.932 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 509' ' ' ASP . . . . . 0.44 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 6.6 m-20 77.11 10.31 2.55 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.524 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.446 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.6 tpmt? -116.09 131.83 56.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.594 0.235 . . . . 0.0 110.679 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 6.6 tpt -66.61 108.42 2.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.119 0.485 . . . . 0.0 111.052 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.66 ' CD2' HG22 ' A' ' 469' ' ' THR . 12.1 m170 -122.74 137.9 54.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.225 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.597 ' CE1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -118.54 122.97 43.95 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.698 0.285 . . . . 0.0 110.721 179.652 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.574 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -168.95 169.8 9.42 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.196 0.522 . . . . 0.0 111.993 -179.302 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.769 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.3 pt? -111.01 169.09 9.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.198 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.401 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -135.37 106.65 6.78 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.389 -0.524 . . . . 0.0 111.59 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.538 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.105 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.811 0.339 . . . . 0.0 111.182 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -61.0 86.32 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.915 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.606 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 585' ' ' ASP . . . . . 0.435 ' O ' ' OD1' ' B' ' 588' ' ' ASP . 3.5 p-10 -86.72 49.14 1.75 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 121.003 0.43 . . . . 0.0 110.872 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.623 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 12.0 pt-20 -87.32 -35.15 18.57 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.326 0.584 . . . . 0.0 110.793 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -84.14 -22.5 31.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.56 -178.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 588' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' B' ' 585' ' ' ASP . 39.0 p-10 -50.75 -51.53 49.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.879 0.371 . . . . 0.0 111.843 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.623 ' CE1' ' O ' ' B' ' 586' ' ' GLU . 2.5 p80 -80.52 -21.96 41.36 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.327 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.985 ' CD1' HD21 ' A' ' 474' ' ' LEU . 31.6 tp -54.69 -33.86 61.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.007 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 83.2 mt -85.85 -29.62 6.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.896 0.379 . . . . 0.0 110.818 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.19 -40.72 96.7 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.382 -179.818 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.806 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.91 -18.11 54.41 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.107 0.48 . . . . 0.0 110.211 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.743 ' N ' HD13 ' B' ' 593' ' ' LEU . 79.8 tt0 -62.78 -32.66 73.86 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.001 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.509 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 8.0 pt-20 -79.5 -47.43 15.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.355 -179.075 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.692 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.0 pp -51.45 -26.7 6.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 120.965 0.412 . . . . 0.0 111.276 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.853 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.8 tp -69.87 -83.04 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.492 0.663 . . . . 0.0 111.435 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.673 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m -141.77 30.19 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.083 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.527 -178.165 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.509 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 4.6 mtp-105 -139.06 40.19 2.12 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.166 -179.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 600' ' ' VAL . . . . . 0.465 ' OXT' HG13 ' B' ' 600' ' ' VAL . 11.2 p . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.092 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.831 0.348 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.495 HG12 ' N ' ' A' ' 453' ' ' GLN . 45.8 t -60.59 158.64 2.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.085 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.495 ' N ' HG12 ' A' ' 452' ' ' VAL . 1.0 OUTLIER -139.12 140.3 37.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.734 179.925 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.533 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.3 t -87.5 104.83 14.68 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.036 0.446 . . . . 0.0 111.126 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.569 ' O ' HG23 ' A' ' 459' ' ' VAL . 28.4 p -132.1 163.0 29.44 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.516 0.674 . . . . 0.0 112.285 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.57 ' HA ' HG23 ' A' ' 496' ' ' ILE . 15.9 mt-10 -59.35 -54.53 45.74 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.126 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -28.25 19.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.777 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -77.65 -35.42 52.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.777 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.839 ' CG1' HD21 ' A' ' 500' ' ' LEU . 6.1 t -76.18 -34.85 26.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.684 0.278 . . . . 0.0 111.743 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.562 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.2 mmm180 -59.82 -37.22 78.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.643 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.3 OUTLIER -68.95 -31.75 70.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.138 179.313 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.478 ' O ' ' O ' ' A' ' 466' ' ' LYS . 14.7 m-30 -62.17 -45.01 95.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.095 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.033 HD11 HD22 ' A' ' 500' ' ' LEU . 0.3 OUTLIER -65.9 -59.23 4.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.09 179.774 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.76 HG22 ' CG ' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -49.24 -25.26 2.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.032 0.444 . . . . 0.0 110.424 179.639 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.581 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 45.5 ttt180 -90.98 -31.19 16.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.134 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.674 ' HE2' ' HD3' ' A' ' 467' ' ' PRO . 0.0 OUTLIER 167.15 167.91 0.11 Allowed Pre-proline 0 CA--C 1.532 0.253 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.592 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.714 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 84.5 Cg_endo -74.43 160.87 41.15 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.283 1.989 . . . . 0.0 114.113 -178.456 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.724 ' SD ' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.56 159.33 44.57 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 114.999 -1.001 . . . . 0.0 111.005 -179.008 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.685 ' O ' HD12 ' A' ' 473' ' ' LEU . 17.4 p -108.45 163.41 13.24 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.514 HG21 ' HA ' ' B' ' 594' ' ' GLU . 0.7 OUTLIER -64.63 -36.76 85.29 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.672 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.872 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -72.97 -50.22 24.61 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.42 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -61.12 -26.2 67.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.474 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.836 HD13 HD11 ' A' ' 497' ' ' LEU . 0.4 OUTLIER -69.1 -46.56 67.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.027 0.441 . . . . 0.0 111.152 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 1.083 HD22 HG22 ' A' ' 490' ' ' VAL . 2.1 pp -84.19 -31.87 24.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.589 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.52 -29.69 2.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.84 0.352 . . . . 0.0 110.922 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.481 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -93.12 -35.17 13.33 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.929 179.625 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.533 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.2 m-85 -73.46 4.41 4.84 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -47.19 174.12 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.014 0.435 . . . . 0.0 111.548 -179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.66 -7.51 15.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.871 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -42.97 -30.93 0.45 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.715 0.293 . . . . 0.0 111.574 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -155.64 -42.03 0.08 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.345 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.41 HG23 ' HB ' ' A' ' 452' ' ' VAL . 0.2 OUTLIER -55.12 -15.94 2.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.211 179.439 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 63.09 19.04 61.02 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.48 -0.867 . . . . 0.0 111.578 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.867 HD21 HG11 ' A' ' 492' ' ' VAL . 6.1 tp -114.07 119.58 37.63 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 120.967 0.413 . . . . 0.0 110.983 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.37 145.81 0.16 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.888 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 3.1 t -58.29 -22.56 53.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.726 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -91.52 -48.75 6.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.716 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.735 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.0 OUTLIER -63.05 -38.7 92.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.872 179.524 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.413 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 96.7 m -51.69 -30.08 20.64 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 1.083 HG22 HD22 ' A' ' 474' ' ' LEU . 4.6 t -82.72 -40.07 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.087 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -60.53 -29.99 69.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.057 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.867 HG11 HD21 ' A' ' 484' ' ' LEU . 4.3 p -100.59 -6.98 9.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.94 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.688 ' CD1' HD22 ' A' ' 497' ' ' LEU . 16.7 tp -93.61 -40.17 10.42 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.073 0.463 . . . . 0.0 110.373 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.611 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -53.96 -42.12 68.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.381 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -40.16 95.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.975 -179.328 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.57 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.2 mt -78.52 -41.67 25.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 112.559 0.578 . . . . 0.0 112.559 -178.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.853 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -37.66 -58.73 0.86 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.524 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.692 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.44 -22.98 62.28 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.369 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.479 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 0.8 OUTLIER -63.56 -18.75 64.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 0.0 110.457 179.133 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.033 HD22 HD11 ' A' ' 463' ' ' LEU . 34.0 mt -62.69 -47.78 82.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.434 -179.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.647 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 28.0 t-20 55.22 54.52 9.94 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.197 -179.069 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.647 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 61.2 Cg_endo -101.72 -161.0 0.04 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 124.209 3.272 . . . . 0.0 111.712 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.76 139.87 51.62 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.565 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 504' ' ' ARG . . . . . 0.447 ' HB2' ' HE1' ' A' ' 511' ' ' MET . 30.1 ptt180 -79.53 132.45 36.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.451 0.643 . . . . 0.0 111.553 -178.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -156.27 130.07 8.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.841 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.407 ' HE2' ' HB2' ' A' ' 506' ' ' MET . 0.1 OUTLIER -76.47 112.29 12.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.908 0.385 . . . . 0.0 111.535 -179.605 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.445 ' HB ' ' ND1' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.52 122.54 42.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.655 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 508' ' ' ASN . . . . . 0.405 ' ND2' HG22 ' A' ' 507' ' ' ILE . 18.6 p30 48.91 37.56 10.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.436 -179.262 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 509' ' ' ASP . . . . . 0.404 ' CB ' ' O ' ' A' ' 508' ' ' ASN . 12.6 t70 80.12 13.03 0.97 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.563 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.431 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -116.28 131.48 56.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.594 179.715 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.469 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -62.05 108.29 1.02 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.087 0.47 . . . . 0.0 110.635 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.566 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 28.6 m80 -123.26 127.87 49.19 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.861 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.63 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.0 OUTLIER -104.92 123.73 48.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.803 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.714 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -178.33 169.47 1.82 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.407 0.622 . . . . 0.0 112.276 -178.756 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.794 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -122.82 168.96 11.6 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.337 178.56 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.97 106.06 8.4 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.207 0.527 . . . . 0.0 111.178 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.76 ' CG ' HG22 ' A' ' 464' ' ' THR . 2.4 pt-20 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.178 -0.915 . . . . 0.0 111.0 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.864 0.364 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -60.91 86.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.569 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -89.97 49.44 1.71 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.974 0.416 . . . . 0.0 110.696 179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.571 ' HA ' ' CE1' ' B' ' 589' ' ' HIS . 15.1 pt-20 -86.42 -36.37 19.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.975 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.32 -22.88 30.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.875 -179.121 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -53.96 -55.11 30.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.008 0.432 . . . . 0.0 111.601 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.571 ' CE1' ' HA ' ' B' ' 586' ' ' GLU . 1.7 p80 -77.49 -21.91 52.06 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.041 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.918 ' CD1' HD21 ' A' ' 474' ' ' LEU . 26.3 tp -58.47 -37.94 76.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.733 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 64.7 mt -86.01 -29.81 6.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.905 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.571 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.32 -40.83 86.0 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-O 121.063 0.459 . . . . 0.0 110.992 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.905 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -80.14 -18.16 50.55 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.957 179.781 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.797 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.1 OUTLIER -63.41 -32.5 73.95 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.614 179.605 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.508 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 7.7 pt-20 -78.93 -46.87 17.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.385 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.727 HD11 ' HB1' ' A' ' 494' ' ' ALA . 1.6 pp -50.76 -26.63 4.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.09 0.471 . . . . 0.0 110.911 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.897 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.2 tp -71.65 -82.58 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.618 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.681 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -142.8 30.9 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-N 114.59 -1.187 . . . . 0.0 110.66 -177.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.508 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.2 OUTLIER -139.35 43.28 2.02 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.209 -179.693 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 31.4 m . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.119 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 451' ' ' ASP . . . . . 0.516 ' N ' ' HZ2' ' A' ' 481' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.784 0.326 . . . . 0.0 111.214 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.731 ' O ' HG22 ' A' ' 482' ' ' THR . 9.1 p -60.62 154.92 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.058 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.418 ' N ' HG22 ' A' ' 452' ' ' VAL . 0.6 OUTLIER -128.08 134.72 49.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.923 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.612 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.3 t -60.75 118.52 3.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.682 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.488 ' O ' HG23 ' A' ' 459' ' ' VAL . 33.4 p -131.67 172.89 11.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.704 0.764 . . . . 0.0 112.489 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.711 ' HA ' HG23 ' A' ' 496' ' ' ILE . 18.2 mt-10 -69.18 -53.26 20.93 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.463 179.237 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -28.46 64.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.955 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.442 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -70.55 -34.34 72.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.569 -179.507 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.802 HG13 HD11 ' A' ' 473' ' ' LEU . 18.6 t -76.15 -37.46 32.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.768 0.318 . . . . 0.0 111.369 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.795 ' O ' HG23 ' A' ' 464' ' ' THR . 1.7 mmm-85 -54.49 -44.57 72.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.073 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.497 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -62.83 -29.25 70.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.446 179.4 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.497 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 10.5 m-30 -68.94 -44.63 72.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.114 0.483 . . . . 0.0 109.909 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.013 HD11 HD22 ' A' ' 500' ' ' LEU . 0.7 OUTLIER -67.31 -59.78 3.13 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.224 -179.858 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.795 HG23 ' O ' ' A' ' 460' ' ' ARG . 17.9 p -47.34 -27.38 1.59 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.009 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.4 mtp85 -88.68 -40.76 13.04 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.015 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.487 ' HD2' ' O ' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -175.96 146.39 0.82 Allowed Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.913 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.673 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 39.9 Cg_endo -65.02 151.76 84.68 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.66 2.24 . . . . 0.0 113.115 -179.234 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.751 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -147.7 163.83 35.46 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.338 0.589 . . . . 0.0 112.072 -179.317 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.625 HG22 ' O ' ' A' ' 511' ' ' MET . 3.0 p -107.62 160.68 15.51 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.177 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.905 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -53.26 -46.65 69.31 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.865 -179.641 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.867 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -58.97 -57.02 14.91 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.03 179.287 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -60.57 -26.73 67.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.759 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.802 HD11 HG13 ' A' ' 459' ' ' VAL . 1.5 tt -77.92 -43.9 28.59 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.02 0.438 . . . . 0.0 111.498 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.918 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.9 pp -84.07 -32.9 24.55 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.251 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.413 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.1 OUTLIER -50.54 -33.4 21.53 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.801 0.334 . . . . 0.0 111.433 -179.428 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -75.21 -42.02 56.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.338 -179.681 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.612 ' CE2' HG22 ' A' ' 454' ' ' VAL . 12.4 m-85 -63.96 -31.2 72.3 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.035 0.445 . . . . 0.0 110.997 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -62.13 113.95 3.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.915 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 3.0 m 74.47 3.28 4.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.496 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -50.38 70.67 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.816 0.341 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 481' ' ' LYS . . . . . 0.516 ' HZ2' ' N ' ' A' ' 451' ' ' ASP . 0.0 OUTLIER 174.74 -30.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.154 179.797 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.731 HG22 ' O ' ' A' ' 452' ' ' VAL . 10.5 p -51.86 -21.24 2.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.072 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 66.83 15.18 64.22 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.547 -0.835 . . . . 0.0 111.98 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.411 ' CD2' HG11 ' A' ' 492' ' ' VAL . 0.8 OUTLIER -88.48 129.34 35.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.98 0.419 . . . . 0.0 111.001 -179.656 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.22 149.92 0.47 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.561 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 486' ' ' SER . . . . . 0.593 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.7 OUTLIER -58.47 -23.31 57.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.176 178.972 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -86.53 -55.06 4.05 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.613 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -60.0 -40.72 90.19 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.241 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.417 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 97.7 m -50.55 -33.37 21.53 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 486' ' ' SER . 4.5 t -76.82 -42.68 33.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.873 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -57.19 -25.97 59.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.391 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.526 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 8.0 p -100.57 -14.92 7.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.266 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.854 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.2 OUTLIER -91.36 -32.32 15.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.009 0.433 . . . . 0.0 110.462 179.893 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.781 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -59.3 -39.84 84.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.8 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.526 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.5 OUTLIER -65.88 -41.4 91.61 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.679 -179.59 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.711 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.8 mt -78.42 -32.29 16.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.897 ' HB3' HD13 ' B' ' 597' ' ' LEU . 1.1 mm? -49.89 -49.85 48.09 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 -178.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.686 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -66.49 -29.07 69.09 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.194 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.57 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.4 mmm180 -58.22 -21.69 48.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.992 0.425 . . . . 0.0 110.453 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.013 HD22 HD11 ' A' ' 463' ' ' LEU . 37.9 mt -60.74 -47.45 86.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.858 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.581 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.0 t-20 56.33 58.56 9.04 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.6 -179.058 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.581 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 95.5 Cg_endo -100.91 -158.95 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 124.027 3.151 . . . . 0.0 111.391 -179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.92 139.98 52.48 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.756 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.47 134.24 36.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.381 0.61 . . . . 0.0 111.407 -178.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -156.12 160.16 39.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.717 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.83 109.36 21.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.901 0.381 . . . . 0.0 111.591 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.516 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.67 110.91 22.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.92 179.072 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 59.58 43.21 16.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.697 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 72.93 12.38 5.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.337 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.43 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.7 tpmt? -116.12 132.8 56.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.634 0.254 . . . . 0.0 110.918 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.625 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -64.23 108.8 1.67 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.999 0.428 . . . . 0.0 110.715 179.802 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.516 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 15.9 m80 -122.64 124.87 44.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.034 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.669 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -105.65 123.81 48.54 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.565 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.673 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -178.81 169.18 1.65 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.162 0.506 . . . . 0.0 112.153 -178.52 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.705 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.5 pt? -118.95 169.23 10.06 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.452 179.028 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.402 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -139.78 106.31 5.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.994 0.426 . . . . 0.0 111.33 179.606 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.907 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.755 0.312 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -62.54 83.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.967 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.664 HG21 ' O3P' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 585' ' ' ASP . . . . . 0.589 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 10.2 t70 -90.04 49.22 1.67 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.005 0.431 . . . . 0.0 110.514 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.604 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 13.5 pt-20 -87.29 -51.89 5.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.035 -0.529 . . . . 0.0 112.025 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 587' ' ' ASP . . . . . 0.42 ' O ' ' HB3' ' B' ' 590' ' ' LEU . 0.6 OUTLIER -84.91 -33.08 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -177.932 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 588' ' ' ASP . . . . . 0.438 ' OD2' ' HA ' ' B' ' 585' ' ' ASP . 6.8 p30 -58.24 -39.68 79.77 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.604 ' CE1' ' O ' ' B' ' 586' ' ' GLU . 0.1 OUTLIER -80.03 -21.0 44.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.528 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.961 ' CD1' HD21 ' A' ' 474' ' ' LEU . 17.3 tp -48.43 -29.82 4.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.024 0.44 . . . . 0.0 110.624 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 591' ' ' ILE . . . . . 0.484 HG23 ' OE2' ' B' ' 594' ' ' GLU . 72.8 mt -85.58 -29.55 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.623 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.586 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.35 -42.83 99.34 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.433 -179.705 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.849 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.58 -17.71 55.7 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.225 0.536 . . . . 0.0 109.845 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.82 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.4 OUTLIER -63.15 -33.8 76.25 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.671 179.686 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.518 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 7.1 pt-20 -78.6 -46.99 18.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.636 -178.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.682 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.5 pp -49.79 -26.68 2.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.101 0.477 . . . . 0.0 111.124 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.899 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.4 tp -72.32 -82.44 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.68 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.711 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.9 m -142.27 30.31 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.774 -177.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.518 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.2 OUTLIER -139.02 39.31 2.13 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.272 -179.579 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.087 179.939 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.864 0.364 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.419 ' C ' HG22 ' A' ' 482' ' ' THR . 11.0 m -155.22 -168.95 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.886 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.13 121.35 6.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 110.68 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.465 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.5 t -78.58 109.7 13.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.917 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 32.2 p -131.83 168.07 18.47 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.65 0.738 . . . . 0.0 112.233 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.662 ' HA ' HG23 ' A' ' 496' ' ' ILE . 23.6 mt-10 -62.53 -52.96 61.39 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.315 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 457' ' ' ASP . . . . . 0.418 ' HA ' ' HG2' ' A' ' 460' ' ' ARG . 0.1 OUTLIER -60.83 -28.46 68.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.251 -179.46 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -67.68 -38.14 83.3 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.863 0.363 . . . . 0.0 111.322 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.841 HG13 HD11 ' A' ' 473' ' ' LEU . 21.0 t -72.38 -32.86 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.947 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.543 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -56.61 -49.61 74.44 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 178.636 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -59.01 -25.02 63.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.727 179.543 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.513 ' HH ' ' HZ ' ' A' ' 477' ' ' PHE . 14.7 m-30 -73.17 -46.54 50.16 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.108 0.48 . . . . 0.0 109.734 178.679 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.875 HD11 HD22 ' A' ' 500' ' ' LEU . 0.6 OUTLIER -65.72 -57.91 6.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.233 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.855 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.26 -27.76 2.67 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.087 0.47 . . . . 0.0 110.506 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 465' ' ' ARG . . . . . 0.578 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 31.0 ttt85 -87.98 -32.64 18.74 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.806 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.578 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER 169.29 153.15 0.15 Allowed Pre-proline 0 CA--C 1.53 0.21 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.746 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.675 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 40.3 Cg_endo -64.96 165.45 21.42 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.64 2.227 . . . . 0.0 113.595 -179.192 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.712 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -159.46 152.78 22.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.407 -179.125 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.692 HG22 ' O ' ' A' ' 511' ' ' MET . 12.3 p -96.82 155.87 16.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.502 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.0 OUTLIER -51.02 -45.86 61.4 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.888 -179.662 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.839 ' CG ' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -59.37 -53.73 54.87 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.033 178.989 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -61.43 -33.41 73.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.625 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.841 HD11 HG13 ' A' ' 459' ' ' VAL . 0.9 OUTLIER -71.01 -41.39 70.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.981 0.42 . . . . 0.0 111.5 -179.583 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.967 ' HB3' HD23 ' A' ' 493' ' ' LEU . 2.4 pp -84.39 -34.77 23.5 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.997 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.429 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -48.96 -31.81 8.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.716 0.293 . . . . 0.0 111.413 -179.385 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.495 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -81.14 -33.84 32.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.238 -179.871 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.513 ' HZ ' ' HH ' ' A' ' 462' ' ' TYR . 15.1 m-85 -74.86 6.81 3.64 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -46.47 171.34 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.904 0.383 . . . . 0.0 111.51 -179.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 2.8 t -66.04 -5.17 8.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.07 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.21 -30.61 0.5 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.605 0.24 . . . . 0.0 111.585 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.0 -45.24 0.2 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.815 0.34 . . . . 0.0 111.398 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.419 HG22 ' C ' ' A' ' 452' ' ' VAL . 10.8 p -59.11 -13.84 8.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.284 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 60.05 21.07 55.46 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.115 -1.04 . . . . 0.0 110.507 -178.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 19.2 tp -111.57 119.58 39.19 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.082 -0.559 . . . . 0.0 111.09 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.86 143.87 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.789 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 486' ' ' SER . . . . . 0.646 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.3 OUTLIER -59.88 -22.07 61.85 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.97 0.414 . . . . 0.0 110.002 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -82.69 -52.83 6.42 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.778 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -63.5 -38.79 92.47 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.978 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.418 HG23 ' HB3' ' A' ' 477' ' ' PHE . 93.0 m -51.45 -30.38 19.41 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.646 HG23 ' O ' ' A' ' 486' ' ' SER . 4.2 t -79.09 -43.15 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.032 179.102 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -57.12 -25.93 59.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.602 179.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.408 ' O ' HG22 ' A' ' 492' ' ' VAL . 7.6 p -100.85 -13.83 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.307 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.967 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.5 OUTLIER -89.33 -37.07 15.17 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.086 0.469 . . . . 0.0 110.452 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.758 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -55.32 -40.22 70.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.386 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -41.27 97.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.156 -179.171 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.662 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.4 mt -75.08 -45.84 41.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.899 ' HB3' HD13 ' B' ' 597' ' ' LEU . 3.2 mm? -36.3 -59.79 0.61 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.347 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.682 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.81 -30.16 68.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.774 0.321 . . . . 0.0 111.809 -178.85 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.408 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 1.2 tpt180 -60.29 -24.34 64.88 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.957 0.408 . . . . 0.0 110.75 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.875 HD22 HD11 ' A' ' 463' ' ' LEU . 52.2 mt -61.07 -47.22 87.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.69 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.574 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 50.2 t-20 58.45 59.12 6.1 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.962 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.574 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 71.5 Cg_endo -101.56 -160.1 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 124.045 3.164 . . . . 0.0 111.441 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.82 139.4 53.2 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.817 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 504' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 505' ' ' LYS . 7.9 ptt85 -79.69 131.54 35.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.482 0.658 . . . . 0.0 111.758 -178.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' A' ' 504' ' ' ARG . 0.1 OUTLIER -148.26 160.13 43.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.406 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.515 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 7.2 ptm -105.03 108.84 20.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.92 0.391 . . . . 0.0 111.295 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.557 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.59 110.88 22.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.011 179.274 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 59.7 41.65 18.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.793 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 509' ' ' ASP . . . . . 0.515 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 1.9 t0 73.95 13.85 4.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.209 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.448 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.11 132.01 56.78 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.926 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.692 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.15 108.7 1.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.095 0.474 . . . . 0.0 110.658 179.759 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.612 ' CE1' HG23 ' A' ' 469' ' ' THR . 19.7 m80 -122.8 127.12 48.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.107 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.627 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.54 123.91 48.81 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.646 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.675 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -177.52 169.39 2.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.254 0.55 . . . . 0.0 112.441 -178.66 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.712 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.4 pt? -117.4 169.18 9.71 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.213 -0.903 . . . . 0.0 108.942 178.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.429 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -138.0 106.45 5.82 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.479 179.787 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.855 ' HB2' HG22 ' A' ' 464' ' ' THR . 8.5 mm-40 . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.761 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.792 0.33 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -61.13 85.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.866 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.589 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 585' ' ' ASP . . . . . 0.412 ' O ' ' OD1' ' B' ' 588' ' ' ASP . 5.5 p-10 -86.66 49.04 1.73 Allowed 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 120.918 0.389 . . . . 0.0 110.761 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.433 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.4 pt-20 -87.09 -31.31 20.53 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.282 0.563 . . . . 0.0 110.658 178.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -84.05 -22.45 31.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.392 -178.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 588' ' ' ASP . . . . . 0.429 ' OD1' ' N ' ' B' ' 589' ' ' HIS . 14.5 p-10 -50.7 -50.26 55.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.883 0.373 . . . . 0.0 111.874 -178.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.433 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.0 OUTLIER -80.53 -23.72 39.83 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.353 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 0.872 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.9 tp -55.15 -35.76 65.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.971 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 67.7 mt -85.88 -29.72 6.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.901 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.539 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.79 -42.62 81.36 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.474 -179.686 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.846 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -75.33 -22.16 57.84 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.2 0.524 . . . . 0.0 109.925 179.559 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.646 ' N ' HD13 ' B' ' 593' ' ' LEU . 72.4 tt0 -63.32 -30.87 71.93 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.888 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.47 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.0 OUTLIER -76.89 -36.88 56.38 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.362 -179.038 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.96 HD11 ' HB1' ' A' ' 494' ' ' ALA . 4.0 pt -61.4 -26.54 39.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.114 0.483 . . . . 0.0 111.183 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.782 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.6 tp -72.83 -81.86 0.05 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.03 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.683 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.2 m -141.41 30.38 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.724 -177.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.47 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.6 OUTLIER -137.46 38.87 2.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.251 -179.746 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.1 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.147 179.921 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.871 0.367 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.798 ' O ' HG22 ' A' ' 482' ' ' THR . 8.7 p -170.27 159.49 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.119 179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.506 ' N ' HG22 ' A' ' 452' ' ' VAL . 0.7 OUTLIER -133.87 140.5 46.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.915 -179.808 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.52 HG22 ' CE2' ' A' ' 477' ' ' PHE . 3.4 t -71.76 110.96 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.339 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.547 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.4 p -131.84 167.32 19.77 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.665 0.745 . . . . 0.0 112.449 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.708 ' HA ' HG23 ' A' ' 496' ' ' ILE . 19.2 mt-10 -63.04 -53.47 53.25 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 114.561 -1.199 . . . . 0.0 110.505 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.37 -28.28 65.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.88 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.438 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -72.63 -34.31 67.22 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.779 -179.462 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.705 ' CG1' HD21 ' A' ' 500' ' ' LEU . 18.3 t -75.97 -36.77 32.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.476 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.522 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -54.51 -45.46 73.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.932 0.396 . . . . 0.0 110.131 179.135 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.498 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -62.16 -29.31 70.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.891 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.681 ' HD2' HD21 ' A' ' 473' ' ' LEU . 10.7 m-30 -68.3 -44.13 76.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.072 0.463 . . . . 0.0 110.178 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 1.03 HD11 HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -67.24 -59.25 3.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.305 -179.657 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.674 HG22 ' CG ' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -49.58 -26.25 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.99 0.424 . . . . 0.0 110.572 179.894 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -90.07 -46.22 8.63 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.009 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.538 ' HE2' ' HG2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -171.78 131.02 0.73 Allowed Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.916 -179.584 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.618 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 10.7 Cg_endo -52.51 163.25 1.86 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.366 2.044 . . . . 0.0 112.405 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.633 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -157.39 159.12 37.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.245 0.545 . . . . 0.0 112.102 -178.609 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.714 HG22 ' O ' ' A' ' 511' ' ' MET . 5.1 p -102.54 155.59 18.17 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.161 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.526 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -51.77 -43.98 63.2 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.859 -179.485 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.844 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -60.54 -58.81 6.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.284 0.564 . . . . 0.0 109.735 178.855 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.16 -20.28 39.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.498 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.702 HD11 HG13 ' A' ' 459' ' ' VAL . 0.5 OUTLIER -87.57 -40.76 13.98 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.887 0.375 . . . . 0.0 111.702 -179.575 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.976 HD22 HG13 ' A' ' 490' ' ' VAL . 1.3 pp -84.03 -49.73 8.65 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.504 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.59 ' HD3' HD12 ' A' ' 474' ' ' LEU . 18.3 mmtp -48.72 -25.34 1.76 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.76 0.314 . . . . 0.0 111.475 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.534 ' HE2' HD23 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -81.55 -43.59 18.52 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.722 179.818 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.52 ' CE2' HG22 ' A' ' 454' ' ' VAL . 8.3 m-85 -59.95 -30.13 68.88 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.092 0.473 . . . . 0.0 110.938 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 478' ' ' GLN . . . . . 0.703 ' O ' HG23 ' A' ' 479' ' ' THR . 12.0 pt20 -79.12 129.04 34.04 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.264 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 479' ' ' THR . . . . . 0.703 HG23 ' O ' ' A' ' 478' ' ' GLN . 0.4 OUTLIER -176.48 -77.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.721 179.663 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 4.2 tptt -177.77 22.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.702 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 14.2 mmtt -109.08 -71.36 0.77 Allowed 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.64 0.257 . . . . 0.0 111.516 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.798 HG22 ' O ' ' A' ' 452' ' ' VAL . 21.0 p -53.22 -12.63 0.41 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.277 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 62.41 20.73 61.47 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 110.561 -1.015 . . . . 0.0 110.561 -178.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.886 ' CD2' HG11 ' A' ' 492' ' ' VAL . 1.3 tp -103.07 123.57 46.9 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.02 -0.59 . . . . 0.0 111.503 -179.041 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.14 154.95 0.33 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.401 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 5.1 p -61.25 -26.3 67.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.515 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -90.73 -42.34 10.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.611 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.603 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.9 mt-30 -65.73 -40.99 92.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.092 179.43 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.464 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 89.5 m -50.28 -29.42 9.63 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.64 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 0.976 HG13 HD22 ' A' ' 474' ' ' LEU . 10.1 t -82.66 -40.85 17.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.004 179.069 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -58.34 -28.2 64.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.389 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 0.886 HG11 ' CD2' ' A' ' 484' ' ' LEU . 4.0 p -102.15 -8.89 9.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.384 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.931 HD23 ' HB3' ' A' ' 474' ' ' LEU . 2.3 tp -93.31 -40.59 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.043 0.449 . . . . 0.0 110.908 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.96 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -53.26 -45.23 68.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.279 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.422 ' O ' ' HD3' ' A' ' 499' ' ' ARG . 0.0 OUTLIER -58.84 -35.99 73.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.001 -179.447 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.708 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.6 mt -81.94 -32.25 11.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.782 ' HB3' HD13 ' B' ' 597' ' ' LEU . 3.5 mm? -50.98 -48.37 61.2 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.421 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.817 ' NZ ' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -62.02 -32.44 72.93 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -178.72 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.554 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 0.9 OUTLIER -57.74 -23.44 52.06 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.954 0.407 . . . . 0.0 110.526 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 1.03 HD22 HD11 ' A' ' 463' ' ' LEU . 50.8 mt -59.92 -47.36 86.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.698 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.592 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.0 t-20 55.91 57.96 9.79 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.44 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.592 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 87.9 Cg_endo -101.38 -160.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 123.879 3.052 . . . . 0.0 111.485 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.61 141.15 48.87 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.625 178.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -79.42 133.66 36.55 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.396 0.617 . . . . 0.0 111.368 -178.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -156.15 160.13 39.63 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.842 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.7 OUTLIER -105.16 110.27 22.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.902 0.382 . . . . 0.0 111.509 -179.813 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.551 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.65 110.92 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.781 178.89 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.5 44.27 15.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.74 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 71.72 13.04 6.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.318 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.442 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.7 tpmt? -116.17 132.03 56.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.644 -0.253 . . . . 0.0 110.886 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 511' ' ' MET . . . . . 0.714 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.3 108.66 1.35 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.993 0.425 . . . . 0.0 110.589 179.721 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.569 ' CE1' HG23 ' A' ' 469' ' ' THR . 16.5 m80 -122.68 125.29 45.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.248 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.61 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -105.22 123.55 48.02 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.516 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.652 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.4 OUTLIER -177.98 169.38 1.97 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.151 0.501 . . . . 0.0 112.21 -178.896 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.723 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.3 pt? -116.57 169.16 9.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.286 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.45 106.43 6.65 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.026 0.441 . . . . 0.0 111.35 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.674 ' CG ' HG22 ' A' ' 464' ' ' THR . 4.7 pt-20 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.121 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.785 0.326 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -60.4 94.36 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.934 179.992 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 584' ' ' TPO . . . . . 0.797 ' O3P' HG22 ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -90.03 49.27 1.68 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.962 0.41 . . . . 0.0 110.644 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 586' ' ' GLU . . . . . 0.558 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 17.9 pt-20 -86.34 -41.37 14.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.599 179.381 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.26 -22.7 30.68 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.532 -179.432 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -51.02 -55.0 19.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.069 0.461 . . . . 0.0 111.611 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 589' ' ' HIS . . . . . 0.558 ' CE1' ' O ' ' B' ' 586' ' ' GLU . 1.7 p80 -79.57 -21.82 44.59 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.205 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 590' ' ' LEU . . . . . 1.0 HD11 ' HA ' ' A' ' 471' ' ' LYS . 37.9 tp -52.68 -29.56 27.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.937 0.399 . . . . 0.0 111.05 -179.936 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 97.3 mt -85.41 -29.5 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 CA-C-O 120.975 0.417 . . . . 0.0 110.786 -179.892 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 592' ' ' TYR . . . . . 0.6 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.91 -45.61 85.16 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.849 -179.507 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 593' ' ' LEU . . . . . 0.788 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -70.02 -18.22 63.3 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.972 0.415 . . . . 0.0 110.373 -179.704 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 594' ' ' GLU . . . . . 0.617 ' N ' HD13 ' B' ' 593' ' ' LEU . 62.5 tt0 -62.8 -30.79 71.74 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 120.853 0.358 . . . . 0.0 110.913 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 595' ' ' GLU . . . . . 0.463 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.3 OUTLIER -80.19 -46.2 16.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.038 -179.343 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 596' ' ' ILE . . . . . 0.63 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -54.91 -26.54 17.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.944 0.402 . . . . 0.0 111.147 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 597' ' ' LEU . . . . . 0.942 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.8 tp -69.17 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.436 0.636 . . . . 0.0 111.833 179.996 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 598' ' ' VAL . . . . . 0.67 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.5 m -140.77 30.02 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.593 -177.8 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 599' ' ' ARG . . . . . 0.463 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 10.4 mtp85 -139.84 39.0 1.99 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.171 -179.576 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 30.3 m . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.115 179.965 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.891 0.377 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 452' ' ' VAL . . . . . 0.541 ' C ' HG22 ' A' ' 482' ' ' THR . 41.3 t 60.39 154.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.394 179.945 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 453' ' ' GLN . . . . . 0.458 ' N ' HG12 ' A' ' 452' ' ' VAL . 0.0 OUTLIER -156.71 128.43 7.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.329 179.467 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.816 HG22 ' CD2' ' A' ' 477' ' ' PHE . 62.6 t -74.19 104.76 2.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.575 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 455' ' ' THR . . . . . 0.44 ' O ' HG23 ' A' ' 459' ' ' VAL . 16.9 p -131.68 158.29 41.49 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.552 0.691 . . . . 0.0 112.483 -179.336 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 456' ' ' GLU . . . . . 0.745 ' HA ' HG23 ' A' ' 496' ' ' ILE . 17.1 mt-10 -50.19 -52.46 35.46 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.655 -1.157 . . . . 0.0 111.171 179.425 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.97 -30.75 71.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.376 -179.196 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 458' ' ' ALA . . . . . 0.454 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -70.52 -56.8 5.7 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.765 0.317 . . . . 0.0 111.461 -179.523 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.738 ' HB ' HD21 ' A' ' 500' ' ' LEU . 21.0 t -48.84 -26.47 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.711 0.291 . . . . 0.0 111.221 -179.574 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 460' ' ' ARG . . . . . 0.517 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.7 OUTLIER -61.73 -49.78 75.06 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.547 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 461' ' ' ARG . . . . . 0.483 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -57.94 -30.75 66.22 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.402 179.351 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 462' ' ' TYR . . . . . 0.495 ' CE2' ' CE2' ' A' ' 477' ' ' PHE . 8.5 m-30 -64.54 -42.58 95.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.189 0.518 . . . . 0.0 109.739 178.867 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 463' ' ' LEU . . . . . 0.83 HD11 HD22 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -71.84 -57.89 3.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.291 -179.9 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 464' ' ' THR . . . . . 0.586 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.07 -26.44 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.812 179.993 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -91.65 -50.68 5.63 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.116 179.785 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 466' ' ' LYS . . . . . 0.443 ' CE ' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -168.18 132.99 1.47 Allowed Pre-proline 0 N--CA 1.452 -0.352 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.054 -179.774 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 467' ' ' PRO . . . . . 0.511 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 37.1 Cg_exo -57.38 146.71 81.63 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.374 2.049 . . . . 0.0 113.116 -179.606 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 468' ' ' MET . . . . . 0.853 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -128.97 177.14 7.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.968 -179.571 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 469' ' ' THR . . . . . 0.725 HG22 ' CD2' ' A' ' 512' ' ' HIS . 1.4 p -115.06 157.16 23.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.919 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 470' ' ' THR . . . . . 0.537 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.6 OUTLIER -54.56 -39.56 67.86 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 120.159 -0.617 . . . . 0.0 110.664 -179.602 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 1.0 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -68.97 -60.39 2.4 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.253 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 472' ' ' ASP . . . . . 0.41 ' HB3' ' H ' ' A' ' 469' ' ' THR . 9.6 t70 -52.96 -24.94 10.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.192 179.893 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 473' ' ' LEU . . . . . 0.853 HD12 ' SD ' ' A' ' 468' ' ' MET . 0.7 OUTLIER -69.98 -40.1 75.56 Favored 'General case' 0 CA--C 1.523 -0.069 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.526 -179.438 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 1.039 HD22 HG22 ' A' ' 490' ' ' VAL . 0.9 OUTLIER -84.78 -25.69 28.04 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -179.499 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 475' ' ' LYS . . . . . 0.771 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 68.6 mmtt -57.68 -44.49 85.82 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -178.828 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 476' ' ' LYS . . . . . 0.775 ' HZ1' ' HA ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -74.39 -43.48 56.21 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.596 179.927 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.816 ' CD2' HG22 ' A' ' 454' ' ' VAL . 5.1 m-85 -59.35 -59.96 4.62 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.062 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 478' ' ' GLN . . . . . 0.504 ' O ' ' O ' ' A' ' 477' ' ' PHE . 0.1 OUTLIER 43.22 175.0 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 113.705 -1.588 . . . . 0.0 112.697 178.806 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 479' ' ' THR . . . . . 0.453 ' HB ' ' O ' ' A' ' 484' ' ' LEU . 14.5 t -77.42 -28.49 52.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.025 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -56.21 -20.93 20.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.0 -179.305 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -111.99 -76.27 0.6 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 482' ' ' THR . . . . . 0.541 HG22 ' C ' ' A' ' 452' ' ' VAL . 47.0 p -60.66 -3.23 0.66 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.585 -179.874 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 63.02 19.96 61.96 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.321 -0.942 . . . . 0.0 111.146 -179.087 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 1.041 HD23 HG11 ' A' ' 492' ' ' VAL . 0.9 OUTLIER -102.42 122.28 43.99 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.504 -0.348 . . . . 0.0 111.098 -179.444 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -39.35 153.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.969 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 486' ' ' SER . . . . . 0.419 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.7 OUTLIER -60.99 -26.15 67.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.261 179.256 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -88.73 -45.95 9.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.382 179.537 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 488' ' ' GLN . . . . . 0.764 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.5 mt-30 -63.48 -41.08 98.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.921 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 489' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 86.0 m -50.28 -30.51 12.03 Favored 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.637 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 490' ' ' VAL . . . . . 1.039 HG22 HD22 ' A' ' 474' ' ' LEU . 7.0 t -83.02 -40.43 16.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.001 179.034 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 491' ' ' ASN . . . . . 0.427 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 5.2 t30 -60.98 -30.87 70.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.938 178.928 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 492' ' ' VAL . . . . . 1.041 HG11 HD23 ' A' ' 484' ' ' LEU . 5.4 p -98.46 -6.85 9.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.887 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.761 HD23 HD23 ' A' ' 474' ' ' LEU . 19.8 tp -95.27 -42.01 8.76 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.994 0.426 . . . . 0.0 110.61 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 494' ' ' ALA . . . . . 0.545 ' HB2' ' HB2' ' B' ' 593' ' ' LEU . . . -54.45 -33.8 60.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.507 -179.921 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -42.79 80.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.125 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 496' ' ' ILE . . . . . 0.745 HG23 ' HA ' ' A' ' 456' ' ' GLU . 12.9 mt -76.08 -46.89 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 112.368 0.506 . . . . 0.0 112.368 -179.06 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.942 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -32.85 -64.33 0.19 Allowed 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -178.483 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 498' ' ' LYS . . . . . 0.63 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -61.47 -31.64 71.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.907 0.384 . . . . 0.0 111.575 -178.956 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 499' ' ' ARG . . . . . 0.427 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 2.4 tpt180 -57.59 -23.42 50.77 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.961 179.79 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.83 HD22 HD11 ' A' ' 463' ' ' LEU . 53.1 mt -62.37 -47.5 83.91 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.819 -179.366 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.591 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 50.9 t-20 56.5 58.31 8.83 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.787 -179.349 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 502' ' ' PRO . . . . . 0.591 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 65.2 Cg_endo -101.2 -158.97 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.338 0 C-N-CA 124.097 3.198 . . . . 0.0 111.536 -179.505 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.15 141.91 47.99 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.76 178.881 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.57 135.49 36.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.282 0.563 . . . . 0.0 111.44 -179.026 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -155.26 157.44 37.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.809 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 506' ' ' MET . . . . . 0.47 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 7.4 ptm -105.13 108.93 20.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.994 0.426 . . . . 0.0 111.598 -179.728 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 507' ' ' ILE . . . . . 0.43 HG12 ' HB2' ' A' ' 512' ' ' HIS . 1.2 mm -90.94 110.77 22.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.082 179.225 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.7 t30 59.03 40.35 22.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.764 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 509' ' ' ASP . . . . . 0.47 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 2.7 t70 76.62 12.12 2.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.359 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.447 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.6 tpmt? -116.17 130.65 56.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.765 0.317 . . . . 0.0 110.925 179.696 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 45.3 mmm -65.7 108.92 2.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.983 0.421 . . . . 0.0 111.023 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 512' ' ' HIS . . . . . 0.725 ' CD2' HG22 ' A' ' 469' ' ' THR . 15.1 m170 -122.15 135.35 54.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.289 179.512 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 513' ' ' PHE . . . . . 0.704 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -110.55 123.44 49.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.664 0.269 . . . . 0.0 111.08 -179.896 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 514' ' ' SER . . . . . 0.716 ' OG ' HD22 ' A' ' 463' ' ' LEU . 2.1 m -174.51 169.57 3.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.475 0.655 . . . . 0.0 112.563 -179.691 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 515' ' ' LEU . . . . . 0.779 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.1 pt? -114.35 169.04 9.33 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.551 178.599 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.414 ' HD2' ' H ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -132.42 106.54 7.94 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.507 179.849 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.586 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.215 -0.897 . . . . 0.0 111.076 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.28 0 CA-C-O 120.728 0.299 . . . . 2.3199999999999998 111.605 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -51.01 -55.06 19.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.993 0.425 . . . . 1.8899999999999999 111.626 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.421 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 1.1 p-80 -79.07 -21.85 46.17 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.749 -0.66 . . . . 0.54000000000000004 111.183 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.931 ' CD1' HD21 ' A' ' 474' ' ' LEU . 28.2 tp -56.44 -33.37 65.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 0.40999999999999998 110.811 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . 0.422 HG23 ' OE2' ' B' ' 594' ' ' GLU . 70.1 mt -85.71 -29.71 6.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.267 -0.424 . . . . 0.68999999999999995 110.804 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.571 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.74 -44.32 86.34 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.142 -0.481 . . . . 1.54 111.446 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.789 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -75.22 -17.94 60.23 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.128 0.489 . . . . 0.32000000000000001 110.032 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.644 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.8 OUTLIER -63.17 -30.78 71.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.005 -0.543 . . . . 1.77 110.853 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 3.7 pt-20 -82.87 -43.92 16.02 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.608 0.596 . . . . 1.8500000000000001 112.608 -178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.684 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.6 pp -51.07 -26.61 4.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.059 0.456 . . . . 0.55000000000000004 111.231 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.872 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.2 tp -71.32 -82.7 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.527 0.68 . . . . 0.35999999999999999 111.733 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.698 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.439 -1.005 0 CA-C-N 114.565 -1.198 . . . . 0.44 110.642 -177.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.592 HG22 ' CE2' ' A' ' 477' ' ' PHE . 14.2 t . . . . . 0 CA--C 1.516 -0.335 0 CA-C-O 120.976 0.417 . . . . 0.58999999999999997 110.78 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.479 ' O ' HG23 ' A' ' 459' ' ' VAL . 28.7 p -131.71 165.34 23.95 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.613 0.72 . . . . 0.38 112.424 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.682 ' HA ' HG23 ' A' ' 496' ' ' ILE . 18.2 mt-10 -60.16 -53.23 60.22 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 114.557 -1.201 . . . . 1.25 110.566 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.32 -28.89 68.49 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.261 -0.881 . . . . 1.29 112.162 -179.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.492 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -71.3 -37.68 71.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.453 -0.34 . . . . 0.38 111.734 -179.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.776 HG13 HD11 ' A' ' 473' ' ' LEU . 21.9 t -72.52 -32.32 41.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.842 -0.343 . . . . 0.28000000000000003 111.541 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.522 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -58.12 -39.56 79.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.391 -0.368 . . . . 2.2599999999999998 110.429 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -67.12 -29.59 69.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 2.54 110.478 179.816 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 5.0 m-30 -69.27 -39.74 78.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 1.27 110.242 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.946 HD11 HD22 ' A' ' 500' ' ' LEU . 2.0 mt -69.89 -63.67 1.03 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.706 -0.679 . . . . 0.39000000000000001 111.733 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.794 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.62 -26.31 1.45 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 0.54000000000000004 110.929 -179.659 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -88.13 -46.81 8.97 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.896 -0.593 . . . . 3.27 111.221 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.8 OUTLIER -170.06 133.94 1.13 Allowed Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.573 -0.285 . . . . 3.9700000000000002 110.891 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.646 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 13.9 Cg_endo -54.83 156.22 15.81 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.444 2.096 . . . . 0.56999999999999995 112.612 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.731 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.47 163.02 39.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.317 0.58 . . . . 0.92000000000000004 111.899 -179.111 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.684 HG22 ' O ' ' A' ' 511' ' ' MET . 4.3 p -106.11 158.92 16.47 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.819 -1.178 . . . . 0.60999999999999999 107.819 177.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.506 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.4 OUTLIER -53.49 -46.62 70.08 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.291 -0.564 . . . . 0.62 110.95 -179.658 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.824 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -59.53 -52.02 67.37 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.885 -0.598 . . . . 1.3200000000000001 110.267 179.171 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -63.61 -32.05 73.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.775 -0.648 . . . . 1.1399999999999999 111.563 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.776 HD11 HG13 ' A' ' 459' ' ' VAL . 0.9 OUTLIER -71.55 -39.39 70.71 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.998 0.428 . . . . 0.95999999999999996 111.354 -179.657 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 1.002 ' HB3' HD23 ' A' ' 493' ' ' LEU . 1.4 pp -83.59 -43.43 15.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.953 -0.567 . . . . 0.55000000000000004 111.548 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.29 -33.98 44.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.5 -0.318 . . . . 2.5299999999999998 111.314 -179.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.458 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -69.52 -39.67 77.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.384 -0.371 . . . . 2.02 111.249 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.592 ' CE2' HG22 ' A' ' 454' ' ' VAL . 15.2 m-85 . . . . . 0 N--CA 1.451 -0.406 0 CA-C-O 121.493 0.663 . . . . 1.25 110.102 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.839 ' CD2' HG11 ' A' ' 492' ' ' VAL . 3.4 mp . . . . . 0 N--CA 1.449 -0.476 0 CA-C-O 120.94 0.4 . . . . 0.97999999999999998 111.226 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.55 157.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.748 -0.66 . . . . 0.66000000000000003 111.688 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.4 -24.35 67.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 1.5700000000000001 110.154 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.421 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 8.7 mt-10 -90.78 -45.17 8.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.779 -0.646 . . . . 1.53 110.544 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.622 ' O ' HG12 ' A' ' 492' ' ' VAL . 4.2 mt-30 -63.38 -42.78 98.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.58 -0.736 . . . . 1.1399999999999999 110.052 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.432 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 93.4 m -50.19 -28.59 7.76 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.086 0.469 . . . . 0.40999999999999998 109.747 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.608 HG13 HD22 ' A' ' 474' ' ' LEU . 5.1 t -84.73 -41.27 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.562 -0.745 . . . . 0.34999999999999998 109.982 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . 0.409 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 3.3 t30 -57.89 -26.13 61.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.265 -0.88 . . . . 0.40999999999999998 110.374 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.839 HG11 ' CD2' ' A' ' 484' ' ' LEU . 3.6 p -101.96 -14.41 8.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.871 -0.604 . . . . 0.31 111.103 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 1.002 HD23 ' HB3' ' A' ' 474' ' ' LEU . 1.4 tp -88.83 -35.98 16.28 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.059 0.456 . . . . 0.98999999999999999 110.585 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.626 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -56.08 -41.97 75.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.556 . . . . 0.28999999999999998 111.305 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.523 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.21 -38.59 91.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.864 -0.607 . . . . 0.82999999999999996 112.259 -179.212 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.682 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.7 mt -79.84 -30.45 13.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 112.922 0.712 . . . . 0.31 112.922 -178.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.872 ' HB3' HD13 ' B' ' 597' ' ' LEU . 1.1 mm? -49.93 -54.12 21.81 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.048 0.388 . . . . 0.56999999999999995 112.048 -178.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.684 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.98 -29.97 68.8 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.504 0.557 . . . . 0.79000000000000004 112.504 -178.336 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.578 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.7 mmm180 -60.48 -22.81 63.93 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.998 0.428 . . . . 2.4100000000000001 110.475 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.946 HD22 HD11 ' A' ' 463' ' ' LEU . 77.0 mt -61.15 -47.56 85.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.779 -0.646 . . . . 0.34000000000000002 111.841 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.616 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.5 t-20 55.89 56.3 9.78 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.028 -0.533 . . . . 0.60999999999999999 110.051 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.616 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 49.2 Cg_endo -99.55 -160.35 0.04 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 123.965 3.11 . . . . 0.26000000000000001 111.518 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.81 140.83 49.31 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 116.042 -0.526 . . . . 1.1699999999999999 109.769 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.57 134.46 36.47 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.384 0.611 . . . . 2.5 111.463 -179.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -156.11 160.14 39.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.105 -0.952 . . . . 0.78000000000000003 109.727 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.415 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.7 OUTLIER -105.04 110.09 22.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.875 0.369 . . . . 0.62 111.643 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.535 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.74 110.9 22.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.38 109.872 179.04 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 32.6 t30 59.12 44.15 16.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.323 -0.398 . . . . 1.3999999999999999 110.829 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 72.02 13.08 5.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.121 -0.49 . . . . 1.6599999999999999 111.414 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.429 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.11 132.95 56.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.616 -0.266 . . . . 1.25 110.885 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.684 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.98 108.67 1.56 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.028 0.442 . . . . 1.1299999999999999 110.747 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.535 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 16.1 m80 -122.75 124.92 44.47 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 1.55 111.026 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.575 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.1 OUTLIER -106.08 123.54 48.16 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.765 -0.457 . . . . 1.27 109.765 178.676 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.67 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.2 OUTLIER 179.6 169.33 1.12 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.163 0.506 . . . . 0.54000000000000004 111.936 -178.907 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.582 ' CD2' ' HB2' ' A' ' 463' ' ' LEU . 0.4 OUTLIER -110.83 169.52 8.7 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.541 -0.754 . . . . 1.52 110.249 179.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.31 105.39 4.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.172 0.51 . . . . 1.1799999999999999 110.867 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.794 ' HG2' HG22 ' A' ' 464' ' ' THR . 4.5 pt-20 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.244 -0.884 . . . . 3.3300000000000001 110.993 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . 0.636 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 120.819 0.342 . . . . 0.0 111.578 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -53.3 -55.02 28.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.021 0.438 . . . . 0.0 111.546 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.405 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 1.0 OUTLIER -79.83 -21.77 43.81 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.254 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.903 HD11 ' HA ' ' A' ' 471' ' ' LYS . 30.0 tp -50.86 -35.43 32.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.184 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 75.3 mt -85.89 -29.42 6.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.898 0.38 . . . . 0.0 110.908 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.535 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.21 -45.23 95.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.294 -179.793 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.794 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.6 -18.53 54.42 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.958 0.409 . . . . 0.0 110.35 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.65 ' N ' HD13 ' B' ' 593' ' ' LEU . 69.1 tt0 -63.19 -30.97 72.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.962 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 6.8 pt-20 -82.43 -42.59 18.36 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 1.002 HD12 ' HE3' ' A' ' 498' ' ' LYS . 1.0 OUTLIER -52.39 -26.79 9.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.224 0.535 . . . . 0.0 111.504 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' A' ' 497' ' ' LEU . 14.3 tp -74.62 -81.07 0.07 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.426 -0.807 . . . . 0.0 112.492 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.678 HG13 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.437 -1.105 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.617 -177.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.532 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.7 t . . . . . 0 CA--C 1.517 -0.319 0 CA-C-O 120.918 0.39 . . . . 0.0 111.025 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 31.4 p -131.91 173.32 11.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.663 0.744 . . . . 0.0 112.605 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.761 ' HA ' HG23 ' A' ' 496' ' ' ILE . 13.3 mt-10 -69.03 -52.53 27.67 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.574 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -27.82 68.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.175 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . . . . . . . . . . . -65.16 -58.07 6.95 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.974 0.416 . . . . 0.0 111.174 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.775 HG11 HD11 ' A' ' 500' ' ' LEU . 21.7 t -52.29 -25.57 7.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.621 -179.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.2 mmm-85 -62.95 -41.8 99.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.927 0.394 . . . . 0.0 110.468 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -23.92 67.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.597 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.521 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 14.7 m-30 -76.04 -44.05 41.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.775 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.68 HD11 HD22 ' A' ' 500' ' ' LEU . 1.1 mt -65.98 -59.67 3.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.748 0.309 . . . . 0.0 111.328 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.513 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -50.0 -26.21 4.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.039 0.447 . . . . 0.0 110.358 179.647 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -88.8 -42.46 11.89 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.724 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.519 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -172.54 161.62 4.07 Favored Pre-proline 0 CA--C 1.531 0.231 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.326 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.643 ' HB2' ' CD2' ' A' ' 512' ' ' HIS . 69.0 Cg_endo -73.3 173.03 14.43 Favored 'Trans proline' 0 N--CA 1.464 -0.252 0 C-N-CA 121.857 1.705 . . . . 0.0 112.91 -179.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.962 ' HG3' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -166.81 159.77 13.98 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-O 121.703 0.763 . . . . 0.0 112.613 -179.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.55 ' HB ' ' HZ2' ' A' ' 471' ' ' LYS . 9.2 p -113.51 155.8 24.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.559 -1.201 . . . . 0.0 108.333 177.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.756 ' HA ' HD12 ' A' ' 473' ' ' LEU . 0.6 OUTLIER -50.74 -43.75 58.23 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.53 -178.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.903 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -60.86 -56.92 15.49 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.153 0.502 . . . . 0.0 109.973 179.016 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -56.78 -19.87 19.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.963 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 1.016 ' CD1' HD11 ' A' ' 497' ' ' LEU . 5.9 mt -81.69 -37.89 26.68 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -179.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.882 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.4 OUTLIER -84.05 -42.53 16.04 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -178.719 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.611 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 26.3 mmtm -47.21 -27.41 1.48 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.686 0.279 . . . . 0.0 111.612 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.478 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -87.33 -40.27 14.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.996 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.532 ' CD2' HG22 ' A' ' 454' ' ' VAL . 15.7 m-85 . . . . . 0 N--CA 1.455 -0.215 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.818 HD21 HG11 ' A' ' 492' ' ' VAL . 9.1 tp . . . . . 0 N--CA 1.452 -0.367 0 CA-C-O 120.962 0.41 . . . . 0.0 111.395 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.94 144.04 3.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.4 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 39.4 t -59.27 -20.03 50.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.786 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.405 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 9.7 mt-10 -94.61 -43.53 8.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.087 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.616 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.4 mt-30 -68.88 -40.75 79.05 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.184 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.513 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 41.4 m -50.87 -28.79 10.3 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.651 HG12 ' HG ' ' B' ' 593' ' ' LEU . 3.5 t -82.01 -41.96 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.395 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -59.52 -28.16 66.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.302 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.818 HG11 HD21 ' A' ' 484' ' ' LEU . 6.3 p -102.02 -6.95 9.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.019 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.612 HD21 ' CB ' ' A' ' 473' ' ' LEU . 10.2 tp -94.27 -44.77 7.8 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.801 0.334 . . . . 0.0 110.936 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.94 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -51.92 -38.1 55.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.207 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.478 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -61.32 -40.08 92.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.185 -179.368 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.761 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.5 mt -74.95 -50.14 26.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 1.016 HD11 ' CD1' ' A' ' 473' ' ' LEU . 0.5 OUTLIER -32.2 -44.15 0.09 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -178.194 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 1.002 ' HE3' HD12 ' B' ' 596' ' ' ILE . 0.1 OUTLIER -70.1 -38.16 75.59 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.576 ' HG3' ' HG2' ' A' ' 456' ' ' GLU . 1.4 mmm180 -58.79 -20.81 53.31 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.963 0.411 . . . . 0.0 110.578 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.775 HD11 HG11 ' A' ' 459' ' ' VAL . 67.4 mt -57.85 -47.58 82.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.86 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.55 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.7 t-20 60.58 58.85 3.92 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.143 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.55 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.0 Cg_endo -101.14 -162.71 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 124.168 3.245 . . . . 0.0 111.943 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.1 138.35 54.23 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.418 178.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.63 131.48 35.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.56 0.695 . . . . 0.0 112.104 -178.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.586 ' HE3' ' CE1' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -156.6 160.43 39.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.307 179.43 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.19 108.88 20.66 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.629 HG12 ' ND1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -89.62 110.81 22.18 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.52 178.185 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 64.28 42.53 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.154 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.3 t0 67.21 20.07 10.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.354 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.405 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.13 130.02 56.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.653 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 7.1 tpt -62.75 106.94 0.87 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.732 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.643 ' CD2' ' HB2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -124.55 156.15 37.84 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.883 -179.251 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.474 ' CZ ' HD23 ' B' ' 597' ' ' LEU . 0.2 OUTLIER -133.21 122.42 23.94 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.674 177.733 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.614 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.1 OUTLIER -177.76 169.33 2.07 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.064 0.459 . . . . 0.0 111.513 -179.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.796 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -123.67 168.0 13.24 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.935 178.59 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.444 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -137.87 106.28 5.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.976 179.558 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.513 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.159 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . 0.631 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.453 -0.293 0 CA-C-O 120.75 0.31 . . . . 0.0 111.579 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -51.7 -55.19 20.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.094 0.473 . . . . 0.0 111.769 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.638 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.1 p-80 -78.69 -21.94 47.46 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.239 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.904 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.3 tp -58.83 -29.49 66.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.08 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 86.2 mt -85.96 -32.54 6.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.638 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.2 OUTLIER -71.71 -38.37 70.54 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.388 -0.525 . . . . 0.0 112.158 -178.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.814 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -70.58 -17.97 62.9 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.112 179.964 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.52 ' N ' HD13 ' B' ' 593' ' ' LEU . 4.2 pt-20 -62.25 -30.68 71.29 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.739 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.416 ' CG ' ' O ' ' B' ' 592' ' ' TYR . 1.5 pt-20 -82.82 -42.96 17.22 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -179.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.667 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.0 pp -52.48 -26.48 9.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.228 0.537 . . . . 0.0 110.816 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.879 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.4 tp -72.85 -82.27 0.05 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.249 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.68 HG22 ' HG ' ' B' ' 597' ' ' LEU . 31.2 m . . . . . 0 N--CA 1.438 -1.052 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.757 -177.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.578 HG22 ' CD2' ' A' ' 477' ' ' PHE . 26.6 t . . . . . 0 CA--C 1.518 -0.285 0 CA-C-O 120.918 0.389 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.425 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.2 p -131.65 167.69 19.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.716 0.77 . . . . 0.0 112.479 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.738 ' HA ' HG23 ' A' ' 496' ' ' ILE . 22.1 mt-10 -62.94 -53.08 59.62 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.645 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -27.42 68.82 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.533 -178.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.446 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -66.66 -58.34 5.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.911 0.386 . . . . 0.0 111.238 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.954 HG13 HD11 ' A' ' 473' ' ' LEU . 16.9 t -49.76 -31.68 6.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.187 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.575 ' HD3' HD23 ' A' ' 500' ' ' LEU . 1.0 OUTLIER -55.54 -47.31 76.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.396 178.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.46 ' HG2' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -60.73 -26.79 67.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.939 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.691 ' HD2' HD21 ' A' ' 473' ' ' LEU . 4.3 m-30 -73.35 -45.35 55.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.048 0.451 . . . . 0.0 110.314 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.04 HD11 HD13 ' A' ' 500' ' ' LEU . 2.5 mt -67.2 -58.46 4.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.842 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.564 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.2 OUTLIER -52.11 -23.84 6.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.908 0.385 . . . . 0.0 110.924 -179.788 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 -93.44 -44.24 8.35 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.308 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.461 ' HE2' ' HG2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -168.15 134.02 1.59 Allowed Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.005 -179.761 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.495 ' HA ' ' HB2' ' A' ' 514' ' ' SER . 30.6 Cg_endo -60.94 142.11 96.57 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.244 1.963 . . . . 0.0 112.607 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.592 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -128.07 178.74 6.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.329 -179.422 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.695 HG23 ' ND1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -119.34 154.26 33.85 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 177.369 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.529 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -51.24 -44.66 61.75 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.04 -0.664 . . . . 0.0 110.839 -179.34 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.831 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -65.6 -54.8 22.72 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.484 178.514 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . 0.426 ' HB3' ' H ' ' A' ' 469' ' ' THR . 24.9 t0 -58.65 -21.16 53.33 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.704 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.954 HD11 HG13 ' A' ' 459' ' ' VAL . 0.4 OUTLIER -80.14 -40.65 26.95 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 121.106 0.479 . . . . 0.0 111.628 -179.606 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.904 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.9 OUTLIER -83.8 -48.53 9.98 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.58 -178.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.597 ' HD3' HD12 ' A' ' 474' ' ' LEU . 29.9 mmtp -48.8 -26.72 2.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.693 0.282 . . . . 0.0 111.667 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.442 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -78.84 -36.16 42.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.1 179.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.59 ' HB2' HG21 ' A' ' 489' ' ' THR . 11.5 m-85 . . . . . 0 CA--C 1.519 -0.212 0 CA-C-O 121.371 0.605 . . . . 0.0 111.009 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.444 ' CD2' HG11 ' A' ' 492' ' ' VAL . 4.7 mp . . . . . 0 N--CA 1.45 -0.474 0 CA-C-O 121.018 0.437 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.42 154.7 1.7 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.581 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . 0.504 ' O ' HG23 ' A' ' 490' ' ' VAL . 53.2 p -62.31 -23.54 66.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.019 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.459 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 14.8 mt-10 -87.44 -51.97 5.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.558 179.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -62.02 -41.79 98.46 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.353 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.59 HG21 ' HB2' ' A' ' 477' ' ' PHE . 62.0 m -49.13 -39.69 29.53 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.744 HG13 HD22 ' A' ' 474' ' ' LEU . 2.3 t -66.42 -49.96 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.385 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.01 -28.36 9.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.762 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.546 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.1 p -102.04 -13.8 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.011 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 1.022 HD22 ' CD2' ' A' ' 497' ' ' LEU . 0.4 OUTLIER -89.49 -41.19 12.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 120.751 0.31 . . . . 0.0 110.841 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.549 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -50.52 -41.2 53.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.08 0.467 . . . . 0.0 110.774 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.546 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -65.85 -40.06 91.37 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.375 -179.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.738 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.4 mt -75.84 -39.17 37.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.914 -179.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 1.022 ' CD2' HD22 ' A' ' 493' ' ' LEU . 2.4 mm? -42.95 -60.34 1.66 Allowed 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -178.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.667 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.79 -28.76 67.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.862 0.363 . . . . 0.0 111.522 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -27.07 66.08 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.172 0.51 . . . . 0.0 110.609 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.04 HD13 HD11 ' A' ' 463' ' ' LEU . 45.0 mt -60.58 -47.41 86.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.744 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.576 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.2 t-20 57.22 58.25 7.8 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.743 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.576 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 78.7 Cg_endo -101.31 -159.63 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.428 0 C-N-CA 124.039 3.159 . . . . 0.0 111.504 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.0 141.8 48.07 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.927 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . 0.454 ' HB2' ' HE1' ' A' ' 511' ' ' MET . 4.3 ppt_? -79.58 135.32 36.57 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.293 0.568 . . . . 0.0 111.315 -179.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.4 mtmt -155.57 134.65 12.17 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.698 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.512 ' HB2' ' HE2' ' A' ' 506' ' ' MET . 12.4 ptm -82.83 110.43 17.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.013 0.435 . . . . 0.0 111.636 -179.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.484 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.68 111.0 22.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.748 178.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 58.9 t30 60.4 38.72 19.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.913 0.387 . . . . 0.0 110.464 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 3.5 t0 78.58 11.79 1.62 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.408 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 507' ' ' ILE . 0.0 OUTLIER -116.26 125.48 52.26 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.694 0.283 . . . . 0.0 111.271 179.83 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.552 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -57.47 109.07 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.987 0.422 . . . . 0.0 110.954 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.695 ' ND1' HG23 ' A' ' 469' ' ' THR . 9.2 m80 -120.43 138.72 53.63 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.722 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.711 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -107.49 124.17 49.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.279 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.495 ' HB2' ' HA ' ' A' ' 467' ' ' PRO . 0.6 OUTLIER -170.34 169.36 7.63 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.608 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.1 pt? -128.9 169.02 15.13 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.893 -1.048 . . . . 0.0 108.997 178.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.409 ' H ' ' HD2' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -129.67 106.54 8.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.017 0.437 . . . . 0.0 111.289 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.564 ' HG2' HG22 ' A' ' 464' ' ' THR . 4.8 pt-20 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.251 -0.88 . . . . 0.0 111.02 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . 0.487 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.078 0 CA-C-O 120.823 0.344 . . . . 0.0 111.565 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -50.86 -44.65 59.64 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.921 0.391 . . . . 0.0 111.331 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -80.31 -21.93 42.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.577 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.922 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.6 tp -55.86 -31.74 63.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.998 0.428 . . . . 0.0 110.861 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.1 mt -85.91 -29.53 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.998 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.544 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.77 -39.81 91.39 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.634 -179.436 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.858 HD23 ' CB ' ' A' ' 494' ' ' ALA . 0.0 OUTLIER -78.63 -18.58 54.28 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.084 0.468 . . . . 0.0 110.037 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.826 ' N ' HD13 ' B' ' 593' ' ' LEU . 52.3 tt0 -63.53 -34.19 77.25 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.445 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -76.68 -44.7 32.6 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -178.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.987 HD12 ' HE2' ' A' ' 498' ' ' LYS . 2.9 pt -50.66 -26.87 4.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 121.158 0.504 . . . . 0.0 111.789 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.786 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.9 tp -75.36 -80.67 0.08 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.43 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.697 HG13 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.437 -1.116 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.602 -177.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.665 HG22 ' CD2' ' A' ' 477' ' ' PHE . 12.5 t . . . . . 0 CA--C 1.516 -0.332 0 CA-C-O 120.971 0.415 . . . . 0.0 110.912 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.551 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.8 p -131.78 165.97 22.59 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.607 0.717 . . . . 0.0 112.485 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.756 ' HA ' HG23 ' A' ' 496' ' ' ILE . 16.9 mt-10 -61.24 -53.74 53.01 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.54 179.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.49 -28.07 65.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.206 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.425 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -74.1 -38.26 63.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.701 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.807 ' HB ' HD21 ' A' ' 500' ' ' LEU . 15.7 t -70.59 -37.92 71.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.206 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 2.0 mmm-85 -52.54 -54.82 27.61 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.481 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -56.45 -27.46 56.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.85 179.497 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.487 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 17.5 m-30 -73.52 -46.96 44.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.13 179.091 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.015 HD11 HD13 ' A' ' 500' ' ' LEU . 2.1 mt -65.79 -57.44 7.97 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.407 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.714 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.2 OUTLIER -48.27 -27.54 2.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.11 0.481 . . . . 0.0 110.421 179.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.493 ' O ' ' HG2' ' A' ' 466' ' ' LYS . 10.8 ttt85 -88.58 -54.08 4.34 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.648 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.538 ' HD3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -158.81 152.13 18.84 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.974 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.567 ' HB2' ' HB3' ' A' ' 512' ' ' HIS . 80.9 Cg_endo -72.97 175.86 9.85 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.619 2.213 . . . . 0.0 112.94 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.697 ' HG3' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -168.46 166.25 12.28 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.204 0.526 . . . . 0.0 112.044 -178.719 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.614 HG22 ' CD2' ' A' ' 512' ' ' HIS . 4.1 p -105.36 154.97 19.57 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 177.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.76 ' HA ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -55.64 -33.71 64.29 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.141 -179.564 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.878 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.1 OUTLIER -69.38 -52.03 31.02 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.309 0.576 . . . . 0.0 109.463 178.9 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -58.82 -31.13 68.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.378 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.939 ' CD1' HD11 ' A' ' 497' ' ' LEU . 3.2 mt -64.7 -48.58 74.15 Favored 'General case' 0 CA--C 1.522 -0.099 0 CA-C-O 120.939 0.399 . . . . 0.0 111.271 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.922 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.8 OUTLIER -79.67 -32.09 41.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.956 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.401 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -58.73 -26.83 64.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.175 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -86.28 -43.05 13.24 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.587 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.665 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.8 m-85 . . . . . 0 N--CA 1.451 -0.42 0 CA-C-O 121.488 0.661 . . . . 0.0 110.192 179.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.565 ' CD2' HG11 ' A' ' 492' ' ' VAL . 3.3 mp . . . . . 0 N--CA 1.45 -0.435 0 CA-C-O 120.914 0.388 . . . . 0.0 111.277 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -41.37 152.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.913 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . 0.544 ' O ' HG23 ' A' ' 490' ' ' VAL . 2.2 p -61.56 -24.72 66.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.07 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -84.36 -53.51 5.41 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.531 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -59.93 -43.46 94.92 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.034 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 54.9 m -47.78 -32.26 5.79 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-O 121.194 0.521 . . . . 0.0 109.704 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.868 HG22 HD22 ' A' ' 474' ' ' LEU . 3.9 t -75.62 -45.47 38.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.04 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -56.51 -27.36 57.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.118 179.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.565 HG11 ' CD2' ' A' ' 484' ' ' LEU . 8.3 p -102.11 -12.77 8.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.087 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.621 HD23 ' HB3' ' A' ' 474' ' ' LEU . 10.2 tp -89.39 -41.3 12.19 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.786 0.327 . . . . 0.0 110.913 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.923 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -53.99 -41.04 67.48 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.013 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.7 OUTLIER -57.17 -41.37 79.13 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.432 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.756 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.8 mt -79.84 -31.2 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -177.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.939 HD11 ' CD1' ' A' ' 473' ' ' LEU . 1.7 mm? -51.07 -50.29 58.98 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -178.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.987 ' HE2' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -69.44 -24.26 63.79 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -177.875 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.551 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 10.5 mmm-85 -61.94 -19.58 62.88 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.226 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.015 HD13 HD11 ' A' ' 463' ' ' LEU . 23.1 mt -66.08 -47.68 73.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.26 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.551 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.5 t-20 56.96 59.37 7.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.547 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.551 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 84.4 Cg_endo -101.02 -157.96 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.375 0 C-N-CA 123.918 3.079 . . . . 0.0 111.465 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.08 139.66 53.02 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.082 179.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.62 135.75 36.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.258 0.551 . . . . 0.0 111.478 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -154.72 160.08 41.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.733 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -104.97 108.9 20.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.902 0.382 . . . . 0.0 111.691 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.542 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.92 110.82 22.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.067 178.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 58.88 44.22 16.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.056 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.1 t70 74.32 8.1 4.57 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.47 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.45 ' O ' ' N ' ' A' ' 507' ' ' ILE . 1.5 tpmt? -113.48 130.79 56.25 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-O 120.651 0.262 . . . . 0.0 110.754 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 5.4 tpt -67.54 108.69 2.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.051 0.453 . . . . 0.0 110.994 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.614 ' CD2' HG22 ' A' ' 469' ' ' THR . 12.0 m170 -122.45 138.17 54.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.632 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.693 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -105.15 133.2 50.31 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.462 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -176.87 169.24 2.46 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.918 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.592 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.3 pt? -129.76 168.9 15.84 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.196 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.406 ' H ' ' HD2' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -133.12 106.48 7.64 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.01 0.434 . . . . 0.0 111.438 179.78 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.714 ' HB2' HG22 ' A' ' 464' ' ' THR . 4.5 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.827 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . 0.587 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.741 0.305 . . . . 0.0 111.752 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 -50.48 -45.77 56.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.93 0.395 . . . . 0.0 111.354 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.719 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.9 p-80 -80.29 -21.88 42.18 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.351 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.943 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.7 tp -64.99 -28.99 69.89 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.324 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 77.9 mt -85.51 -32.71 7.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.719 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.58 -39.29 70.66 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.464 -0.495 . . . . 0.0 111.837 -179.243 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.815 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -70.72 -17.9 62.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.202 0.525 . . . . 0.0 110.081 -179.822 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.774 ' N ' HD13 ' B' ' 593' ' ' LEU . 3.8 pt-20 -63.21 -30.8 71.87 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.012 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -83.01 -43.0 16.86 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.696 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.9 pp -52.22 -26.59 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.196 0.522 . . . . 0.0 110.935 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.877 HD22 ' HG ' ' A' ' 497' ' ' LEU . 11.8 tp -69.56 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.336 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.694 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.44 -0.974 0 CA-C-N 114.693 -1.139 . . . . 0.0 110.575 -178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.621 HG22 ' CE2' ' A' ' 477' ' ' PHE . 19.3 t . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 121.008 0.432 . . . . 0.0 110.674 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 26.3 p -131.55 173.39 11.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.644 0.735 . . . . 0.0 112.66 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.669 ' HA ' HG23 ' A' ' 496' ' ' ILE . 15.1 mt-10 -68.04 -53.07 28.5 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.385 179.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.83 -28.8 62.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.192 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -70.04 -58.24 4.05 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.748 0.309 . . . . 0.0 111.347 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.806 HG13 HD11 ' A' ' 473' ' ' LEU . 19.2 t -51.75 -26.31 6.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.759 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.591 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.3 mmm-85 -63.09 -44.42 95.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.804 0.335 . . . . 0.0 110.336 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.452 ' HG2' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -61.74 -24.98 67.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.504 179.684 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.507 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 4.0 m-30 -71.61 -46.37 59.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.998 0.428 . . . . 0.0 110.153 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.071 HD11 HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -65.91 -58.29 5.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.479 -179.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.742 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -50.46 -23.92 2.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.932 0.396 . . . . 0.0 110.599 179.788 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.5 mtt85 -94.11 -42.67 8.87 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.417 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.466 ' HD2' ' O ' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -173.36 156.28 2.85 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 120.766 0.317 . . . . 0.0 111.27 -179.737 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.615 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 71.8 Cg_endo -73.62 147.3 40.21 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.743 2.295 . . . . 0.0 113.463 -179.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.762 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -143.35 149.58 37.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.846 -179.702 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.626 HG22 ' O ' ' A' ' 511' ' ' MET . 12.1 p -90.14 177.37 6.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 176.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.87 HG22 ' CD2' ' A' ' 497' ' ' LEU . 0.5 OUTLIER -70.97 -34.96 71.92 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.147 -0.621 . . . . 0.0 111.06 -179.735 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.873 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -72.48 -49.5 32.69 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.661 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -60.77 -34.49 74.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.691 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.808 HD22 HD11 ' A' ' 493' ' ' LEU . 0.9 OUTLIER -64.19 -42.22 96.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.973 0.416 . . . . 0.0 110.9 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 1.026 HD22 HG22 ' A' ' 490' ' ' VAL . 3.0 pp -84.13 -33.06 24.37 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.741 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.636 ' N ' HD12 ' A' ' 474' ' ' LEU . 0.1 OUTLIER -49.06 -26.83 2.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.617 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -86.09 -43.63 12.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.492 -179.825 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.621 ' CE2' HG22 ' A' ' 454' ' ' VAL . 5.4 m-85 . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 121.112 0.482 . . . . 0.0 111.406 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.999 HD23 HG11 ' A' ' 492' ' ' VAL . 1.1 mp . . . . . 0 N--CA 1.449 -0.519 0 CA-C-O 121.016 0.436 . . . . 0.0 111.028 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.78 155.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.709 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.5 m -60.63 -22.64 64.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.129 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.448 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 8.6 mt-10 -91.23 -44.93 8.92 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.61 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.752 ' O ' HG12 ' A' ' 492' ' ' VAL . 2.2 mt-30 -65.41 -40.62 93.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.115 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 70.2 m -51.02 -28.57 10.4 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.21 0.529 . . . . 0.0 109.595 178.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 1.026 HG22 HD22 ' A' ' 474' ' ' LEU . 14.4 t -84.97 -41.64 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.831 178.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . 0.463 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 7.1 t30 -60.96 -29.22 69.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.025 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.999 HG11 HD23 ' A' ' 484' ' ' LEU . 7.3 p -98.6 -7.25 9.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.924 179.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.808 HD11 HD22 ' A' ' 473' ' ' LEU . 39.2 tp -94.61 -46.89 6.76 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 121.029 0.442 . . . . 0.0 110.714 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.671 ' CB ' HD23 ' B' ' 593' ' ' LEU . . . -49.74 -34.12 18.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.401 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.7 OUTLIER -68.35 -44.07 76.09 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.72 -179.493 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.669 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.5 mt -79.39 -32.64 14.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.877 ' HG ' HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -44.12 -56.99 3.65 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.589 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.696 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.9 -33.36 71.75 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -178.097 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.575 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 14.3 mmm180 -56.64 -22.18 32.44 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.981 0.42 . . . . 0.0 110.814 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.071 HD22 HD11 ' A' ' 463' ' ' LEU . 93.6 mt -59.64 -47.6 84.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.171 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.595 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.0 t-20 58.36 57.48 6.41 Favored Pre-proline 0 C--N 1.32 -0.716 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.311 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.595 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 56.5 Cg_endo -99.84 -159.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 124.137 3.225 . . . . 0.0 111.363 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.8 139.78 52.65 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.771 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 5.3 ptt-85 -79.64 133.44 36.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.488 0.661 . . . . 0.0 111.5 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -156.25 160.21 39.58 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.664 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.403 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -103.86 110.39 22.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.995 0.426 . . . . 0.0 111.502 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.483 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.64 110.86 22.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.942 179.085 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.3 t30 59.8 43.13 15.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.841 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 73.28 12.36 4.85 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.35 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.413 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -116.1 131.38 56.96 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.866 179.826 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.626 ' O ' HG22 ' A' ' 469' ' ' THR . 28.9 mmm -62.9 108.49 1.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.061 0.457 . . . . 0.0 110.552 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.493 ' CE1' HG23 ' A' ' 469' ' ' THR . 23.7 m80 -122.76 125.52 45.65 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.081 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.626 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -104.92 123.37 47.63 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 178.71 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.615 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER 179.43 169.37 1.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.08 0.467 . . . . 0.0 111.33 -178.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.791 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -118.78 168.7 10.5 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.641 178.547 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.43 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -136.9 106.05 6.0 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.082 0.467 . . . . 0.0 111.219 179.54 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.742 ' HG2' HG22 ' A' ' 464' ' ' THR . 3.2 pt-20 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.087 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . 0.408 ' HA ' ' HB3' ' B' ' 590' ' ' LEU . 1.3 p-10 . . . . . 0 N--CA 1.451 -0.415 0 CA-C-O 120.823 0.344 . . . . 0.0 111.541 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -56.15 -55.25 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.083 0.468 . . . . 0.0 111.699 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.692 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.5 p-80 -76.57 -21.97 54.93 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.319 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.925 ' CD1' HD21 ' A' ' 474' ' ' LEU . 19.5 tp -61.06 -29.32 69.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.452 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 82.6 mt -85.92 -34.4 8.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.692 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.4 OUTLIER -71.53 -40.74 69.87 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 120.51 -0.476 . . . . 0.0 112.163 -178.812 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.836 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.4 -18.62 65.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.211 0.529 . . . . 0.0 110.052 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.536 ' N ' HD13 ' B' ' 593' ' ' LEU . 14.3 tt0 -63.62 -30.41 71.52 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.551 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.52 -48.05 18.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.241 -178.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.856 HD11 ' HB1' ' A' ' 494' ' ' ALA . 1.6 pp -51.16 -26.68 5.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.103 0.478 . . . . 0.0 110.94 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.997 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.2 tp -62.48 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.541 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.696 HG22 ' HG ' ' B' ' 597' ' ' LEU . 34.9 m . . . . . 0 N--CA 1.438 -1.06 0 CA-C-N 114.877 -1.056 . . . . 0.0 111.245 -177.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.617 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.1 t . . . . . 0 CA--C 1.518 -0.264 0 CA-C-O 120.996 0.427 . . . . 0.0 110.802 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.521 ' O ' HG23 ' A' ' 459' ' ' VAL . 28.2 p -131.65 167.97 18.54 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.585 0.707 . . . . 0.0 112.533 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.59 ' HA ' HG23 ' A' ' 496' ' ' ILE . 17.7 mt-10 -65.1 -54.87 23.33 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.188 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -50.59 -28.39 8.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.654 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.412 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -76.92 -35.83 57.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.762 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.875 HG12 HD21 ' A' ' 500' ' ' LEU . 13.2 t -76.1 -31.89 22.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.709 0.29 . . . . 0.0 111.446 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.539 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.1 mmm180 -61.43 -41.24 96.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.211 179.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.454 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -65.81 -29.01 69.42 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.407 179.275 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.454 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 11.4 m-30 -64.3 -45.74 86.66 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.051 HD11 HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -64.56 -59.05 4.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.876 179.534 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.639 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.82 -26.6 1.7 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.234 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -88.89 -49.32 6.87 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.809 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.446 ' HD3' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -171.78 162.81 4.72 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.114 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.504 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 97.4 Cg_endo -80.37 160.08 22.82 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.763 2.309 . . . . 0.0 113.292 -179.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.631 ' HE3' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -157.21 168.2 28.11 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.369 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.589 HG22 ' CD2' ' A' ' 512' ' ' HIS . 4.6 p -100.75 176.1 5.42 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 176.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.429 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -71.33 -30.85 66.69 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 119.992 -0.683 . . . . 0.0 111.401 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.856 ' HB3' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -77.17 -50.17 13.56 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.569 0.699 . . . . 0.0 109.388 178.53 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -57.91 -31.4 66.73 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.12 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.644 HD11 HG13 ' A' ' 459' ' ' VAL . 0.9 OUTLIER -70.49 -39.22 74.31 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-O 120.989 0.423 . . . . 0.0 110.664 179.852 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.925 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.1 pp -84.2 -33.15 24.22 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.938 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.581 ' N ' HD12 ' A' ' 474' ' ' LEU . 0.0 OUTLIER -47.42 -27.67 1.79 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.372 -179.058 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.452 ' HE3' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -85.35 -43.08 13.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.171 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.617 ' CE2' HG22 ' A' ' 454' ' ' VAL . 10.0 m-85 . . . . . 0 N--CA 1.455 -0.214 0 CA-C-O 121.109 0.48 . . . . 0.0 111.26 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.828 ' CD2' HG11 ' A' ' 492' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 120.937 0.398 . . . . 0.0 111.131 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -43.9 149.93 0.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.669 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.76 -21.65 61.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.467 179.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.431 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 12.6 mt-10 -91.59 -49.17 6.44 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.716 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.628 ' O ' HG12 ' A' ' 492' ' ' VAL . 6.7 mt-30 -62.57 -42.09 99.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.31 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 87.1 m -49.11 -29.6 5.47 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.246 0.546 . . . . 0.0 109.692 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.883 HG22 HD22 ' A' ' 474' ' ' LEU . 13.7 t -83.12 -41.99 17.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.061 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -59.81 -31.97 70.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.063 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.828 HG11 ' CD2' ' A' ' 484' ' ' LEU . 7.6 p -94.86 -11.62 8.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.825 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.642 HD11 HD22 ' A' ' 497' ' ' LEU . 11.5 tp -90.22 -44.89 9.44 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.926 0.393 . . . . 0.0 110.777 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.856 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -50.76 -33.9 25.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.569 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.505 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -67.81 -40.56 83.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.789 -179.279 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.59 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.7 mt -77.99 -43.42 28.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.997 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.2 OUTLIER -37.77 -56.24 1.1 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -178.466 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.698 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.78 -23.56 63.38 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.557 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.488 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 0.1 OUTLIER -64.74 -18.53 65.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.137 0.494 . . . . 0.0 110.204 179.114 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.051 HD22 HD11 ' A' ' 463' ' ' LEU . 29.9 mt -59.7 -47.59 85.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.104 -179.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.644 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.8 t-20 56.63 54.99 8.24 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.287 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.644 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.2 Cg_endo -101.41 -160.27 0.04 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 124.249 3.3 . . . . 0.0 111.67 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.75 141.29 48.76 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.658 178.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.64 133.55 36.4 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.4 0.619 . . . . 0.0 111.512 -178.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -156.29 160.18 39.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.007 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.12 109.78 21.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.866 0.365 . . . . 0.0 111.347 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.498 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -90.73 110.86 22.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.021 179.071 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 58.6 t30 58.88 44.91 15.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.804 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.2 t70 71.57 13.24 6.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.201 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.401 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.09 127.59 54.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.636 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.16 108.51 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.921 0.391 . . . . 0.0 110.438 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.589 ' CD2' HG22 ' A' ' 469' ' ' THR . 9.0 m-70 -122.47 128.22 50.58 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.946 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.636 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -104.89 122.88 46.71 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.733 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.504 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER 179.25 169.33 1.01 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.069 0.461 . . . . 0.0 111.437 -178.757 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.79 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -120.34 168.88 10.83 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.521 178.331 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.01 106.15 7.09 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.136 0.494 . . . . 0.0 111.204 179.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.639 ' HG2' HG22 ' A' ' 464' ' ' THR . 2.7 pt-20 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.057 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.779 0.323 . . . . 0.0 111.597 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -50.93 -55.21 18.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.953 0.406 . . . . 0.0 111.719 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.659 ' O ' HD12 ' B' ' 593' ' ' LEU . 0.5 OUTLIER -80.11 -21.9 42.75 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.164 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.9 ' CD1' HD21 ' A' ' 474' ' ' LEU . 39.7 tp -54.43 -47.6 72.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.004 0.43 . . . . 0.0 110.859 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 48.9 mt -86.24 -29.6 6.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.785 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.584 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.06 -45.46 77.29 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.387 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 1.111 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -67.96 -20.34 65.05 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.172 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.623 ' N ' HD13 ' B' ' 593' ' ' LEU . 5.8 tt0 -63.44 -30.86 71.92 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.323 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' B' ' 592' ' ' TYR . 0.3 OUTLIER -70.83 -45.83 63.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.532 -179.537 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 1.059 HD11 ' HB1' ' A' ' 494' ' ' ALA . 5.1 pt -58.14 -26.62 29.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.307 0.575 . . . . 0.0 110.678 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.874 HD13 ' HB3' ' A' ' 497' ' ' LEU . 12.2 tp -72.31 -81.74 0.05 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.1 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.754 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.7 m . . . . . 0 N--CA 1.438 -1.059 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.593 -177.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.764 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.2 t . . . . . 0 CA--C 1.519 -0.227 0 CA-C-O 120.83 0.348 . . . . 0.0 110.382 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 459' ' ' VAL . 35.0 p -131.49 170.71 14.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.689 0.757 . . . . 0.0 112.779 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.733 ' HA ' HG23 ' A' ' 496' ' ' ILE . 23.8 mt-10 -69.06 -52.97 22.98 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.328 -1.305 . . . . 0.0 110.73 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.92 -27.5 68.86 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.314 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.466 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -69.71 -36.71 76.15 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.458 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.879 ' HB ' HD21 ' A' ' 500' ' ' LEU . 15.6 t -70.67 -36.92 67.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.808 0.337 . . . . 0.0 110.911 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.583 ' HD3' HD23 ' A' ' 500' ' ' LEU . 1.5 mmm-85 -52.76 -49.56 65.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.953 178.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.532 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -61.66 -23.74 66.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.014 179.8 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.54 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 8.4 m-30 -75.17 -42.62 55.57 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.223 0.535 . . . . 0.0 109.605 178.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.04 HD11 HD13 ' A' ' 500' ' ' LEU . 1.8 mt -69.46 -57.66 4.97 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.454 -179.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.672 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.1 OUTLIER -48.28 -27.58 2.58 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.091 0.472 . . . . 0.0 110.364 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.656 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 15.2 mtt180 -83.96 -55.75 4.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.517 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.656 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER -163.72 146.37 7.78 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.657 -179.936 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.577 ' HG2' HG13 ' A' ' 507' ' ' ILE . 43.9 Cg_endo -68.1 161.52 44.05 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.64 2.227 . . . . 0.0 113.139 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.595 ' CE ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -159.64 166.61 30.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.567 -179.227 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.883 HG22 ' O ' ' A' ' 511' ' ' MET . 51.8 p -98.73 178.56 4.94 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 1.111 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -71.19 -40.74 71.02 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.612 179.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.783 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -64.47 -52.2 59.19 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.264 0.554 . . . . 0.0 109.852 179.013 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . 0.41 ' H ' ' HG2' ' A' ' 471' ' ' LYS . 46.3 t0 -59.94 -25.04 64.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.621 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.86 HD11 HG13 ' A' ' 459' ' ' VAL . 1.4 tt -86.13 -45.47 11.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.004 0.431 . . . . 0.0 111.616 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.9 HD21 ' CD1' ' B' ' 590' ' ' LEU . 3.6 pp -76.09 -44.1 40.36 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.087 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.557 ' N ' HD12 ' A' ' 474' ' ' LEU . 0.1 OUTLIER -52.34 -24.27 7.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.681 0.277 . . . . 0.0 111.204 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.592 ' HG2' ' N ' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -76.99 -44.43 31.09 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.521 -179.424 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.764 ' CE2' HG22 ' A' ' 454' ' ' VAL . 9.1 m-85 . . . . . 0 CA--C 1.513 -0.466 0 CA-C-O 121.593 0.711 . . . . 0.0 109.753 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.808 ' CD2' HG11 ' A' ' 492' ' ' VAL . 5.0 mp . . . . . 0 N--CA 1.448 -0.552 0 CA-C-O 120.963 0.411 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.66 158.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.704 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 14.7 m -60.84 -27.2 67.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.127 0.489 . . . . 0.0 110.089 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.464 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 4.3 mt-10 -86.95 -46.63 9.69 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.415 179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.474 ' O ' HG12 ' A' ' 492' ' ' VAL . 4.2 mt-30 -63.2 -40.34 97.21 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.0 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 96.7 m -50.71 -28.07 8.32 Favored 'General case' 0 C--N 1.335 -0.058 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.746 HG13 HD22 ' A' ' 474' ' ' LEU . 4.6 t -82.05 -44.16 19.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.107 179.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -56.31 -25.85 50.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.754 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.808 HG11 ' CD2' ' A' ' 484' ' ' LEU . 6.9 p -100.31 -14.17 7.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.546 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.633 HD23 ' CB ' ' A' ' 474' ' ' LEU . 0.2 OUTLIER -91.0 -35.22 14.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.888 0.375 . . . . 0.0 110.91 -179.776 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 1.059 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -58.33 -38.54 77.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.273 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.6 OUTLIER -63.13 -40.83 98.72 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.424 -179.614 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.733 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.3 mt -79.02 -44.31 24.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.569 -178.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.874 ' HB3' HD13 ' B' ' 597' ' ' LEU . 2.3 mm? -41.15 -50.91 3.5 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.888 ' NZ ' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -64.26 -33.17 75.21 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.873 0.368 . . . . 0.0 111.948 -178.768 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.469 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 0.7 OUTLIER -55.9 -23.3 30.53 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.003 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.04 HD13 HD11 ' A' ' 463' ' ' LEU . 56.8 mt -59.99 -47.54 85.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.924 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.547 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 24.9 t-20 58.13 59.94 6.18 Favored Pre-proline 0 C--N 1.32 -0.715 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.503 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.547 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 84.7 Cg_endo -101.06 -157.29 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.306 0 C-N-CA 123.966 3.111 . . . . 0.0 111.419 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.01 140.44 51.91 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.012 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.8 135.14 36.41 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.337 0.589 . . . . 0.0 111.579 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 14.7 mtmt -156.11 159.26 38.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.587 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.415 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -105.17 111.65 24.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.031 0.443 . . . . 0.0 111.722 -179.64 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.577 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.89 110.94 22.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.001 179.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 9.4 t30 58.62 42.96 19.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.836 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 74.45 12.38 3.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.391 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 507' ' ' ILE . 0.0 OUTLIER -116.17 130.96 57.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.854 179.824 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.883 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.97 109.1 1.68 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.962 0.41 . . . . 0.0 111.022 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.563 ' CD2' HG23 ' A' ' 469' ' ' THR . 11.1 m170 -122.31 138.21 54.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.886 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.707 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.1 OUTLIER -111.13 128.33 55.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.114 179.408 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.539 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -179.89 169.24 1.28 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.239 0.542 . . . . 0.0 112.16 -179.097 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.684 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.2 pt? -122.03 169.19 11.08 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.206 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.6 106.62 8.3 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.418 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.672 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.107 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' B' ' 590' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.379 0 CA-C-O 120.871 0.367 . . . . 0.0 111.617 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -52.06 -55.26 21.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.744 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.711 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.2 p-80 -77.63 -21.86 51.61 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.251 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.953 ' CD1' HD21 ' A' ' 474' ' ' LEU . 23.4 tp -61.93 -29.46 70.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.344 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 76.0 mt -85.97 -34.64 8.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.711 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.67 -43.54 65.84 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 120.346 -0.542 . . . . 0.0 112.065 -179.018 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 1.121 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -64.08 -18.85 64.79 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.166 -179.656 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.625 ' N ' HD13 ' B' ' 593' ' ' LEU . 3.7 pt-20 -63.55 -30.74 71.81 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.8 -48.48 25.14 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.97 -179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.621 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.1 pp -53.72 -26.52 13.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.275 0.559 . . . . 0.0 110.721 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.942 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.1 tp -71.85 -82.44 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.969 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.718 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.4 m . . . . . 0 N--CA 1.438 -1.041 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.76 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.624 HG22 ' CE2' ' A' ' 477' ' ' PHE . 3.9 t . . . . . 0 CA--C 1.518 -0.287 0 CA-C-O 120.879 0.371 . . . . 0.0 110.693 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 459' ' ' VAL . 32.5 p -131.77 168.14 18.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.68 0.752 . . . . 0.0 112.578 -179.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.757 ' HA ' HG23 ' A' ' 496' ' ' ILE . 20.9 mt-10 -61.59 -53.33 57.65 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.359 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.41 ' HA ' ' HG2' ' A' ' 460' ' ' ARG . 0.2 OUTLIER -64.12 -27.86 69.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.237 -179.257 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.438 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -68.54 -35.81 77.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.363 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.899 ' HB ' HD21 ' A' ' 500' ' ' LEU . 19.0 t -73.52 -35.38 44.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.903 0.383 . . . . 0.0 110.865 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.62 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -52.98 -51.36 61.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.816 178.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.513 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -56.15 -30.33 62.02 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.794 179.693 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.704 ' HH ' ' HZ ' ' A' ' 477' ' ' PHE . 11.0 m-30 -71.25 -41.71 69.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.081 0.467 . . . . 0.0 110.205 179.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.019 HD11 HD13 ' A' ' 500' ' ' LEU . 1.9 mt -70.8 -58.96 3.09 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.446 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.704 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.56 -27.75 2.97 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.048 0.451 . . . . 0.0 110.756 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -85.91 -52.14 5.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.887 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -166.48 130.49 1.62 Allowed Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.904 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.512 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 12.2 Cg_endo -55.0 160.76 7.42 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.62 2.213 . . . . 0.0 112.708 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.713 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -154.23 178.0 10.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.457 0.646 . . . . 0.0 111.718 -179.156 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.729 HG22 ' CD2' ' A' ' 512' ' ' HIS . 1.3 p -111.24 159.54 17.81 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 1.121 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -53.9 -48.09 70.49 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.539 -179.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.794 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -56.98 -53.45 57.88 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.251 179.555 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -62.65 -33.47 75.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.727 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.797 HD11 HG13 ' A' ' 459' ' ' VAL . 1.3 tt -70.53 -41.65 72.29 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 121.093 0.473 . . . . 0.0 111.418 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.953 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.4 pp -84.19 -37.3 22.03 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.241 -179.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.07 -40.45 61.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.749 0.309 . . . . 0.0 111.219 -179.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.447 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -61.97 -41.68 98.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.138 -179.842 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.704 ' HZ ' ' HH ' ' A' ' 462' ' ' TYR . 13.3 m-85 . . . . . 0 N--CA 1.45 -0.449 0 CA-C-O 121.507 0.67 . . . . 0.0 110.464 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.701 HD13 HG11 ' A' ' 492' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.449 -0.482 0 CA-C-O 120.997 0.427 . . . . 0.0 111.337 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.92 158.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.582 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . 0.494 ' O ' HG23 ' A' ' 490' ' ' VAL . 12.2 p -62.0 -25.03 67.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.971 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.427 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 18.6 mt-10 -89.0 -51.15 5.75 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.354 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.514 ' HB3' HD23 ' A' ' 484' ' ' LEU . 0.1 OUTLIER -60.2 -42.93 96.13 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.237 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 47.9 m -49.55 -37.69 28.14 Favored 'General case' 0 CA--C 1.522 -0.12 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 179.082 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.577 HG12 ' HG ' ' B' ' 593' ' ' LEU . 2.7 t -71.19 -46.75 64.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.065 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.79 -25.83 43.15 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.567 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.701 HG11 HD13 ' A' ' 484' ' ' LEU . 9.1 p -101.75 -14.48 8.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.541 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.922 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.1 OUTLIER -91.41 -35.74 14.2 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.968 0.414 . . . . 0.0 110.543 179.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.611 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -56.44 -37.01 69.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.092 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.498 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.38 -41.49 80.5 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.768 -179.473 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.757 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.2 mt -77.35 -39.37 27.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.094 -179.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.942 ' HB3' HD13 ' B' ' 597' ' ' LEU . 1.4 mm? -42.73 -59.26 2.0 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.65 ' HA ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -60.04 -30.89 69.49 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -178.798 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.405 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 0.4 OUTLIER -56.52 -23.76 41.88 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.019 HD13 HD11 ' A' ' 463' ' ' LEU . 55.9 mt -61.43 -47.49 85.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.756 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.567 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 58.78 59.41 5.6 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.598 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.567 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 77.3 Cg_endo -101.22 -159.32 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.356 0 C-N-CA 123.996 3.131 . . . . 0.0 111.555 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.77 139.87 52.5 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.724 178.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -79.64 133.94 36.42 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.411 0.624 . . . . 0.0 111.592 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 19.2 mtmt -156.3 159.86 39.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.569 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.409 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 0.1 OUTLIER -105.17 111.83 24.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.965 0.412 . . . . 0.0 111.656 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.494 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -90.79 110.92 22.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.976 178.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 58.73 42.87 19.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.818 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . 0.409 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 0.4 OUTLIER 74.58 12.76 3.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.353 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' A' ' 507' ' ' ILE . 0.0 OUTLIER -116.22 129.25 56.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.681 0.276 . . . . 0.0 110.94 179.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 2.9 tpt -62.13 108.57 1.09 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.013 0.435 . . . . 0.0 110.643 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.729 ' CD2' HG22 ' A' ' 469' ' ' THR . 10.8 m170 -122.64 126.98 48.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.137 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.72 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.08 123.75 48.5 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.902 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.707 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.4 OUTLIER -178.94 169.51 1.57 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.158 0.504 . . . . 0.0 112.062 -178.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.755 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.4 pt? -116.07 169.15 9.48 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.332 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.403 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -136.48 106.67 6.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.996 0.427 . . . . 0.0 111.429 179.706 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.704 ' HG2' HG22 ' A' ' 464' ' ' THR . 4.9 pt-20 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.151 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p30 . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.722 0.296 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -52.9 -45.7 67.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.017 0.437 . . . . 0.0 111.25 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.426 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 2.2 p-80 -80.03 -23.43 41.44 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.077 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.941 HD12 HD21 ' A' ' 474' ' ' LEU . 27.3 tp -68.05 -38.85 82.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.801 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.4 mt -85.88 -29.64 6.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.612 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.76 -43.23 80.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.786 -179.455 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.795 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -71.35 -18.16 62.39 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.081 0.467 . . . . 0.0 110.196 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.764 ' N ' HD13 ' B' ' 593' ' ' LEU . 2.4 pt-20 -63.03 -31.67 72.86 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.469 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' B' ' 592' ' ' TYR . 1.0 OUTLIER -76.95 -49.35 15.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.776 -179.364 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.629 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -54.8 -26.54 17.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.155 0.502 . . . . 0.0 110.83 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.95 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.8 tp -69.0 -83.36 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.92 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.66 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.2 m . . . . . 0 N--CA 1.438 -1.027 0 CA-C-N 114.656 -1.157 . . . . 0.0 110.707 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.659 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.0 t . . . . . 0 CA--C 1.517 -0.296 0 CA-C-O 121.019 0.437 . . . . 0.0 110.905 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.549 ' O ' HG23 ' A' ' 459' ' ' VAL . 27.5 p -131.79 172.18 12.61 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.586 0.707 . . . . 0.0 112.575 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.621 ' HA ' HG23 ' A' ' 496' ' ' ILE . 17.0 mt-10 -69.04 -54.82 13.07 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.475 -1.239 . . . . 0.0 110.05 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.04 -27.07 7.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.46 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -75.91 -37.92 58.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.752 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.74 HG13 HD11 ' A' ' 473' ' ' LEU . 6.6 t -74.57 -40.81 48.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.863 0.364 . . . . 0.0 111.428 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.717 ' CD ' HD23 ' A' ' 500' ' ' LEU . 2.4 mmm-85 -54.43 -39.53 67.46 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.232 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -71.01 -26.66 63.22 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.761 179.48 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.516 ' HH ' ' HZ ' ' A' ' 477' ' ' PHE . 15.6 m-30 -67.59 -36.96 81.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.132 0.491 . . . . 0.0 109.918 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.028 HD11 HD22 ' A' ' 500' ' ' LEU . 0.6 OUTLIER -74.84 -58.53 3.23 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.082 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.679 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.42 -28.26 2.04 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-O 121.15 0.5 . . . . 0.0 110.398 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 37.7 mtt85 -85.36 -48.58 8.9 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.561 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.48 130.21 0.54 Allowed Pre-proline 0 CA--C 1.532 0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.984 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.505 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 11.2 Cg_endo -53.65 157.18 10.25 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.753 2.302 . . . . 0.0 112.576 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.664 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.95 172.24 16.0 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.405 0.622 . . . . 0.0 111.694 -179.415 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.891 HG22 ' O ' ' A' ' 511' ' ' MET . 35.1 p -103.73 160.69 14.56 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 177.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.557 ' CG2' HD21 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -54.52 -43.72 72.14 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.057 -0.657 . . . . 0.0 110.487 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.855 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -61.24 -59.12 5.8 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.797 178.871 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -56.85 -20.44 22.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.581 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.74 HD11 HG13 ' A' ' 459' ' ' VAL . 1.6 tt -87.87 -42.4 12.55 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.015 0.436 . . . . 0.0 111.446 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.959 ' HB3' HD23 ' A' ' 493' ' ' LEU . 2.0 pp -84.38 -48.04 10.08 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.144 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 32.6 mmtt -48.83 -29.84 5.08 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -179.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.446 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -68.52 -41.68 79.61 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.932 -179.841 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.659 ' CE2' HG22 ' A' ' 454' ' ' VAL . 11.5 m-85 . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 111.021 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.911 ' CD2' HG11 ' A' ' 492' ' ' VAL . 1.6 tp . . . . . 0 N--CA 1.452 -0.334 0 CA-C-O 121.011 0.434 . . . . 0.0 111.088 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.33 151.29 0.37 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.66 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 m -59.96 -24.71 64.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.454 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.426 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 4.3 mt-10 -91.35 -45.78 8.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.553 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.764 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.5 mt-30 -63.46 -41.32 98.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.077 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.497 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 85.6 m -50.32 -30.28 11.69 Favored 'General case' 0 C--N 1.334 -0.087 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.807 HG22 HD13 ' A' ' 474' ' ' LEU . 5.0 t -83.62 -39.85 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.989 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . 0.426 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 4.9 t30 -61.04 -31.17 70.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.907 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.911 HG11 ' CD2' ' A' ' 484' ' ' LEU . 4.0 p -97.1 -12.49 8.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.861 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.959 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.3 OUTLIER -91.06 -40.9 11.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.176 0.512 . . . . 0.0 110.024 179.409 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.696 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -50.28 -36.64 32.35 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.257 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.9 OUTLIER -66.9 -42.87 84.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.297 -179.607 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.621 HG23 ' HA ' ' A' ' 456' ' ' GLU . 7.1 mt -77.74 -43.79 29.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.468 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.95 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -36.05 -57.67 0.69 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.664 ' HA ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -62.52 -22.77 66.55 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.29 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.514 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 1.4 mmp_? -60.14 -19.88 55.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.937 0.399 . . . . 0.0 110.69 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.028 HD22 HD11 ' A' ' 463' ' ' LEU . 16.4 mt -64.46 -47.92 77.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.044 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.582 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 56.81 59.07 8.21 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.403 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.582 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 73.9 Cg_endo -101.09 -160.22 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 124.02 3.147 . . . . 0.0 111.669 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.76 141.03 49.83 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.681 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.53 134.82 36.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.291 0.567 . . . . 0.0 111.591 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 10.9 mtmt -156.08 160.2 39.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.608 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -103.41 109.96 21.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.977 0.418 . . . . 0.0 111.699 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.515 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.73 110.81 22.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.869 178.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 58.35 44.53 18.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.975 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.5 t0 72.83 11.8 5.31 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.478 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 507' ' ' ILE . 1.8 tpmt? -116.08 128.81 55.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.606 0.241 . . . . 0.0 110.701 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.891 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -62.86 108.63 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.953 0.406 . . . . 0.0 110.581 180.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.806 ' CD2' HG23 ' A' ' 469' ' ' THR . 10.4 m170 -122.56 129.47 51.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.825 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.596 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -108.91 123.47 49.13 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.775 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.764 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.5 OUTLIER -177.89 169.34 2.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.059 0.457 . . . . 0.0 111.959 -178.57 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.737 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.5 pt? -114.12 169.13 9.25 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.468 179.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.4 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -137.57 106.71 6.02 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.052 0.453 . . . . 0.0 111.499 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.679 ' HG2' HG22 ' A' ' 464' ' ' THR . 3.8 pt-20 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.171 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.5 p30 . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.745 0.307 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -51.76 -47.15 64.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.033 0.444 . . . . 0.0 110.976 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.415 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 2.3 p-80 -80.13 -25.06 40.07 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.04 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.892 ' CD1' HD21 ' A' ' 474' ' ' LEU . 21.5 tp -58.94 -29.96 67.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.839 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 80.5 mt -85.86 -29.7 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.229 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.574 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.58 -38.13 88.64 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.799 -179.291 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.83 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.98 -17.9 54.6 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.153 0.502 . . . . 0.0 110.106 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.804 ' N ' HD13 ' B' ' 593' ' ' LEU . 1.1 pt-20 -61.8 -31.27 71.48 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.817 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 8.3 pt-20 -82.49 -47.13 12.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.406 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.687 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.1 pp -51.76 -26.74 7.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.018 0.437 . . . . 0.0 111.219 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.922 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.4 tp -68.47 -83.33 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.58 0.705 . . . . 0.0 111.516 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.674 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m . . . . . 0 N--CA 1.437 -1.115 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.43 -178.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.553 HG22 ' CD2' ' A' ' 477' ' ' PHE . 4.6 t . . . . . 0 CA--C 1.517 -0.324 0 CA-C-O 120.978 0.418 . . . . 0.0 110.707 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.724 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.6 p -131.58 159.65 37.6 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.552 0.692 . . . . 0.0 112.644 -179.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.654 ' HA ' HG23 ' A' ' 496' ' ' ILE . 19.8 mt-10 -54.73 -54.69 38.58 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.505 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.34 -28.35 42.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.924 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.416 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -80.22 -33.14 38.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.968 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.724 HG23 ' O ' ' A' ' 455' ' ' THR . 2.8 t -75.8 -36.04 32.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.768 0.318 . . . . 0.0 111.472 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.609 ' HD3' HD23 ' A' ' 500' ' ' LEU . 2.3 mmm-85 -57.46 -38.62 74.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.919 0.39 . . . . 0.0 110.088 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.453 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -70.31 -29.12 65.76 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.562 179.298 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.453 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 7.1 m-30 -64.83 -38.78 92.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.14 0.495 . . . . 0.0 109.813 179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.079 HD11 HD22 ' A' ' 500' ' ' LEU . 0.3 OUTLIER -73.97 -58.27 3.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.193 -179.63 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.764 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.89 -27.8 2.31 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 121.143 0.497 . . . . 0.0 110.478 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -87.57 -49.73 6.98 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.792 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.41 ' HA ' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -169.28 125.98 0.79 Allowed Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.138 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.551 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 9.2 Cg_endo -52.14 158.42 5.16 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.707 2.271 . . . . 0.0 112.878 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.681 ' CE ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -151.13 168.46 24.58 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-O 121.451 0.643 . . . . 0.0 111.968 -179.528 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.635 HG22 ' CD2' ' A' ' 512' ' ' HIS . 2.1 p -100.9 176.37 5.3 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 176.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.473 ' CG2' HD21 ' B' ' 593' ' ' LEU . 0.1 OUTLIER -71.04 -41.51 70.71 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 119.781 -0.767 . . . . 0.0 110.616 179.655 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.858 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -64.62 -49.69 70.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.669 178.659 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . 0.544 ' HA ' ' HD3' ' A' ' 475' ' ' LYS . 11.5 t70 -59.13 -40.1 84.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.247 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.69 HD11 ' CG1' ' A' ' 459' ' ' VAL . 1.0 OUTLIER -62.15 -41.27 98.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.096 0.474 . . . . 0.0 111.137 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.892 HD21 ' CD1' ' B' ' 590' ' ' LEU . 1.0 OUTLIER -84.46 -26.03 28.49 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.314 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.544 ' HD3' ' HA ' ' A' ' 472' ' ' ASP . 0.0 OUTLIER -54.85 -36.51 65.13 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.577 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.499 ' CE ' ' HA ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -81.38 -43.75 18.55 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.063 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.553 ' CD2' HG22 ' A' ' 454' ' ' VAL . 11.5 m-85 . . . . . 0 N--CA 1.451 -0.392 0 CA-C-O 121.288 0.566 . . . . 0.0 109.857 178.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.826 ' CD2' HG11 ' A' ' 492' ' ' VAL . 3.3 mp . . . . . 0 N--CA 1.446 -0.657 0 CA-C-O 121.004 0.431 . . . . 0.0 111.091 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -39.53 155.06 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.636 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 p -62.7 -20.39 64.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.463 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.415 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 4.0 mt-10 -95.48 -39.95 9.72 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.748 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.624 ' O ' HG12 ' A' ' 492' ' ' VAL . 14.0 mt-30 -69.26 -43.76 73.29 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.568 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 90.1 m -49.18 -28.99 4.93 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 121.271 0.558 . . . . 0.0 109.839 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.622 HG22 HD22 ' A' ' 474' ' ' LEU . 17.4 t -84.28 -39.98 15.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.631 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . 0.46 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 9.4 t30 -60.99 -29.91 69.97 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.975 178.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.826 HG11 ' CD2' ' A' ' 484' ' ' LEU . 7.6 p -97.48 -13.14 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.938 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.834 HD23 ' HB3' ' A' ' 474' ' ' LEU . 5.6 tp -90.95 -43.76 9.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.129 0.49 . . . . 0.0 110.107 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.717 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -49.29 -33.87 14.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.543 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.9 OUTLIER -69.09 -43.19 75.0 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.877 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.654 HG23 ' HA ' ' A' ' 456' ' ' GLU . 6.4 mt -78.93 -32.43 15.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -178.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.922 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -46.05 -57.72 4.21 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.687 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.96 -29.19 68.25 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -178.26 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.553 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 4.0 mmm180 -58.29 -22.08 51.46 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.91 0.386 . . . . 0.0 110.681 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.079 HD22 HD11 ' A' ' 463' ' ' LEU . 65.2 mt -58.74 -47.62 83.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.529 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.615 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.1 t-20 56.48 57.45 9.02 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.507 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.615 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.9 Cg_endo -101.74 -163.26 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.44 0 C-N-CA 124.175 3.25 . . . . 0.0 111.843 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . 0.406 ' O ' ' CD ' ' A' ' 505' ' ' LYS . 0.1 OUTLIER -116.39 145.07 43.52 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.038 178.51 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -83.24 132.91 35.02 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.404 0.621 . . . . 0.0 111.985 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.406 ' CD ' ' O ' ' A' ' 503' ' ' GLU . 0.0 OUTLIER -150.32 159.67 44.29 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.455 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.461 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 0.0 OUTLIER -105.1 112.17 25.21 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.605 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.468 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.7 OUTLIER -90.89 110.92 22.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.025 179.237 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.7 t30 58.85 41.99 20.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.764 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . 0.461 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 1.3 t70 74.37 14.89 3.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.252 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' A' ' 506' ' ' MET . 0.0 OUTLIER -116.26 131.61 56.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 110.908 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.488 ' HA ' ' HE3' ' A' ' 511' ' ' MET . 3.7 tpt -62.54 108.4 1.13 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.93 0.395 . . . . 0.0 110.687 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.635 ' CD2' HG22 ' A' ' 469' ' ' THR . 10.4 m170 -122.84 128.81 50.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.408 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.639 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.73 123.36 48.02 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.701 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.813 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.6 OUTLIER 179.11 169.13 0.97 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.107 0.48 . . . . 0.0 111.985 -178.857 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.758 ' CD2' HD12 ' A' ' 463' ' ' LEU . 1.6 pt? -114.04 169.17 9.21 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.382 178.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -142.42 106.52 4.74 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.083 0.468 . . . . 0.0 111.382 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.764 ' HB2' HG22 ' A' ' 464' ' ' THR . 2.7 mm-40 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.847 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.307 0 CA-C-O 120.737 0.303 . . . . 0.0 111.763 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -53.33 -55.21 26.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.011 0.434 . . . . 0.0 111.73 -179.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.677 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.2 p-80 -77.08 -21.63 54.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.334 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 1.078 HD13 HD21 ' A' ' 474' ' ' LEU . 24.3 tp -60.6 -29.52 69.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.544 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 79.0 mt -85.75 -34.32 8.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.677 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.78 -40.89 68.93 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.359 -0.537 . . . . 0.0 112.161 -178.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.808 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -66.5 -18.54 65.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.103 0.478 . . . . 0.0 110.246 -179.762 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.771 ' HA ' HG21 ' A' ' 470' ' ' THR . 4.1 pt-20 -63.4 -30.87 71.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.597 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.1 -47.97 17.08 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.126 -179.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.615 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.1 pp -52.33 -26.59 9.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.214 0.531 . . . . 0.0 110.89 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.913 HD22 ' HG ' ' A' ' 497' ' ' LEU . 13.1 tp -69.61 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.483 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.772 HG22 ' HG ' ' B' ' 597' ' ' LEU . 34.4 m . . . . . 0 N--CA 1.439 -1.014 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.65 -178.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.865 HG22 ' CD2' ' A' ' 477' ' ' PHE . 79.0 t . . . . . 0 CA--C 1.515 -0.38 0 CA-C-O 120.902 0.382 . . . . 0.0 110.555 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.603 ' O ' HG23 ' A' ' 459' ' ' VAL . 23.4 p -131.52 157.78 42.66 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 121.556 0.693 . . . . 0.0 112.481 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.822 ' HA ' HG23 ' A' ' 496' ' ' ILE . 22.9 mt-10 -51.38 -53.36 37.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.475 -1.239 . . . . 0.0 110.941 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.71 -31.46 72.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.56 -179.151 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.437 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -71.37 -36.69 71.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.396 -179.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.798 ' HB ' HD21 ' A' ' 500' ' ' LEU . 16.4 t -72.31 -25.7 23.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.121 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.2 OUTLIER -63.11 -51.04 68.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.109 0.48 . . . . 0.0 109.814 178.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.485 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -54.93 -28.09 48.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 179.394 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.505 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 12.9 m-30 -68.81 -45.31 71.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.148 179.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.808 HD11 HD22 ' A' ' 500' ' ' LEU . 0.7 OUTLIER -68.47 -57.4 5.88 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.238 179.704 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.71 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.84 -24.51 1.47 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.789 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.572 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 24.4 ttp180 -93.35 -31.33 14.7 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.531 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.572 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER 169.89 162.7 0.2 Allowed Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.662 -179.588 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.681 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 73.9 Cg_endo -72.0 163.31 39.2 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.341 2.027 . . . . 0.0 113.34 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.751 ' SD ' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -152.15 152.64 32.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.383 -178.794 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.714 HG23 ' CE1' ' A' ' 512' ' ' HIS . 0.6 OUTLIER -95.9 162.4 13.59 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.021 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.771 HG21 ' HA ' ' B' ' 594' ' ' GLU . 1.8 p -65.3 -34.11 77.57 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.853 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.846 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -73.63 -50.91 18.73 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.35 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -59.73 -19.68 51.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.228 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.764 HD13 HD11 ' A' ' 497' ' ' LEU . 0.4 OUTLIER -75.24 -41.25 57.91 Favored 'General case' 0 C--O 1.23 0.051 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.133 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 1.078 HD21 HD13 ' B' ' 590' ' ' LEU . 1.3 pp -84.33 -46.53 11.66 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 37.4 mmtt -46.69 -29.23 1.78 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.773 0.32 . . . . 0.0 111.479 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.488 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -78.06 -41.24 36.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.642 179.547 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.865 ' CD2' HG22 ' A' ' 454' ' ' VAL . 16.5 m-85 . . . . . 0 N--CA 1.452 -0.339 0 CA-C-O 121.298 0.57 . . . . 0.0 110.073 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.911 ' CD2' HG11 ' A' ' 492' ' ' VAL . 4.3 mp . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 120.961 0.41 . . . . 0.0 111.279 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.26 156.72 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.729 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . 0.4 ' O ' HG23 ' A' ' 490' ' ' VAL . 1.0 OUTLIER -62.26 -24.13 67.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.09 178.861 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.405 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 10.7 mt-10 -88.84 -48.35 7.54 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.577 179.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.701 ' O ' HG12 ' A' ' 492' ' ' VAL . 3.1 mt-30 -60.42 -43.25 96.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.997 179.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 92.7 m -49.43 -29.36 6.33 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 121.111 0.481 . . . . 0.0 109.785 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 1.012 HG22 HD22 ' A' ' 474' ' ' LEU . 8.2 t -83.55 -40.97 16.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.937 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . 0.411 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 3.3 t30 -60.96 -29.78 69.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.98 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.911 HG11 ' CD2' ' A' ' 484' ' ' LEU . 6.8 p -99.03 -6.97 9.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.823 179.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.704 ' CD1' HD22 ' A' ' 497' ' ' LEU . 9.6 tp -94.88 -34.58 12.38 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.003 0.43 . . . . 0.0 110.483 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.538 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -61.29 -37.02 81.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.109 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.463 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.5 OUTLIER -66.45 -45.27 80.34 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.849 -179.483 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.822 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.9 mt -73.93 -40.15 52.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.79 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.913 ' HG ' HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -38.82 -63.04 0.55 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.891 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.645 ' HA ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.5 -27.99 66.65 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -58.81 -21.06 55.44 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.083 0.468 . . . . 0.0 110.992 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.808 HD22 HD11 ' A' ' 463' ' ' LEU . 84.5 mt -61.67 -47.76 83.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.503 -179.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.59 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.9 t-20 60.95 57.67 3.59 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.04 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.59 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 58.5 Cg_endo -101.22 -160.63 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 124.291 3.327 . . . . 0.0 111.771 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.95 138.21 54.5 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.782 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.68 133.61 36.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.388 0.613 . . . . 0.0 111.719 -178.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -156.33 146.99 21.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.81 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.458 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 0.0 OUTLIER -89.22 111.26 22.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.94 0.4 . . . . 0.0 111.362 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.53 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.78 110.93 22.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.172 179.299 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 1.5 t30 60.06 41.85 16.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.906 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . 0.458 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 3.9 t0 74.22 13.82 3.87 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.223 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 506' ' ' MET . 0.0 OUTLIER -116.08 130.64 56.9 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.838 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.675 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -60.51 108.7 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 0.0 110.718 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.714 ' CE1' HG23 ' A' ' 469' ' ' THR . 19.4 m80 -122.58 155.75 35.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.673 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.746 ' CD1' HD21 ' B' ' 597' ' ' LEU . 5.3 p90 -134.29 123.69 24.62 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.757 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.681 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER 179.77 169.43 1.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.391 0.615 . . . . 0.0 112.03 -178.99 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.811 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -118.54 168.86 10.28 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.425 178.454 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.406 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -135.07 106.02 6.61 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.167 0.508 . . . . 0.0 111.165 179.369 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.71 ' HG2' HG22 ' A' ' 464' ' ' THR . 1.8 pt-20 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.023 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.277 0 CA-C-O 120.739 0.304 . . . . 0.0 111.784 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -52.72 -55.16 24.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.091 0.472 . . . . 0.0 111.56 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.409 ' HA ' ' HB3' ' B' ' 592' ' ' TYR . 1.0 OUTLIER -79.7 -21.89 44.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.181 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.87 ' CD1' HD21 ' A' ' 474' ' ' LEU . 28.2 tp -52.0 -39.81 60.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.043 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 54.5 mt -86.06 -29.71 6.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.134 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.559 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.57 -39.61 84.9 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.45 -179.781 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.804 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.52 -18.0 55.38 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.156 0.503 . . . . 0.0 109.92 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.75 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.4 OUTLIER -63.43 -30.76 71.84 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.974 179.709 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 6.5 pt-20 -80.73 -47.41 14.0 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.721 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.5 pp -50.15 -26.54 3.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.138 0.494 . . . . 0.0 110.991 179.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.972 HD13 ' HB3' ' A' ' 497' ' ' LEU . 11.9 tp -64.63 -83.77 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.307 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.74 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.8 m . . . . . 0 N--CA 1.436 -1.147 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.188 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.525 HG22 ' CE2' ' A' ' 477' ' ' PHE . 7.5 t . . . . . 0 CA--C 1.514 -0.418 0 CA-C-O 121.019 0.438 . . . . 0.0 110.636 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.504 ' O ' HG23 ' A' ' 459' ' ' VAL . 23.2 p -132.02 164.29 26.52 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.539 0.685 . . . . 0.0 112.192 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.701 ' HA ' HG23 ' A' ' 496' ' ' ILE . 18.6 mt-10 -57.33 -53.47 57.79 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.506 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.99 -29.22 63.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.07 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.406 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -74.6 -35.06 62.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.644 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.754 ' CG1' HD21 ' A' ' 500' ' ' LEU . 14.2 t -76.02 -28.36 18.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 120.859 -0.337 . . . . 0.0 111.511 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -62.73 -50.82 69.57 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.46 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -55.43 -27.04 45.46 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.356 179.053 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.507 ' O ' ' O ' ' A' ' 466' ' ' LYS . 11.4 m-30 -68.38 -44.44 75.14 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.084 HD11 HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -70.58 -54.36 12.36 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.099 179.318 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.448 HG22 ' CG ' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.09 -24.65 1.17 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.673 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.606 ' O ' ' HG2' ' A' ' 466' ' ' LYS . 3.5 ptp85 -97.04 -47.84 5.63 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.336 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.689 ' HD3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -165.77 166.79 9.64 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 122.316 0.247 . . . . 0.0 110.708 179.905 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.689 ' HD2' ' HD3' ' A' ' 466' ' ' LYS . 97.0 Cg_endo -77.15 162.86 31.17 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.276 1.984 . . . . 0.0 113.551 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.706 ' SD ' HD11 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -156.14 151.16 26.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.168 -178.74 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.673 HG22 ' O ' ' A' ' 511' ' ' MET . 10.9 p -99.11 175.06 6.03 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.506 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.6 OUTLIER -71.31 -31.52 67.53 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.333 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.85 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -77.0 -53.52 7.72 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.325 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -57.89 -19.94 33.2 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.757 178.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.883 HD12 HD11 ' A' ' 497' ' ' LEU . 6.8 mt -77.27 -40.92 42.94 Favored 'General case' 0 C--O 1.23 0.054 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.895 HD22 HG22 ' A' ' 490' ' ' VAL . 1.6 pp -84.22 -47.37 10.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.562 ' N ' HD12 ' A' ' 474' ' ' LEU . 18.0 mmtp -46.85 -28.33 1.53 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.698 0.285 . . . . 0.0 111.484 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.52 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -79.56 -41.03 28.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.653 179.545 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.525 ' CE2' HG22 ' A' ' 454' ' ' VAL . 16.8 m-85 . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 121.529 0.681 . . . . 0.0 110.053 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.906 HD23 HG11 ' A' ' 492' ' ' VAL . 1.5 mp . . . . . 0 N--CA 1.451 -0.395 0 CA-C-O 120.919 0.39 . . . . 0.0 111.422 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.93 154.23 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.82 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . 0.533 ' O ' HG23 ' A' ' 490' ' ' VAL . 74.2 m -61.15 -26.41 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.139 179.002 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -84.61 -53.28 5.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.443 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.581 ' O ' HG12 ' A' ' 492' ' ' VAL . 0.9 OUTLIER -59.66 -40.48 87.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.023 179.392 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 44.2 m -51.43 -31.06 21.62 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.895 HG22 HD22 ' A' ' 474' ' ' LEU . 2.5 t -78.86 -42.59 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.309 179.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.51 -34.05 72.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.897 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.906 HG11 HD23 ' A' ' 484' ' ' LEU . 7.3 p -93.7 -10.46 9.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.75 179.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.588 ' HG ' HD23 ' A' ' 497' ' ' LEU . 21.2 tp -90.24 -44.39 9.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.092 0.473 . . . . 0.0 110.554 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.716 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -51.61 -33.9 35.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.69 -179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.74 -41.9 78.34 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.216 -179.093 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.701 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.5 mt -79.13 -29.95 14.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.972 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.3 OUTLIER -47.63 -58.35 4.38 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.489 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.721 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.42 -28.05 66.59 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -177.856 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.556 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.5 mmm180 -60.38 -20.84 61.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.057 0.456 . . . . 0.0 110.19 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.084 HD22 HD11 ' A' ' 463' ' ' LEU . 77.4 mt -59.59 -47.61 84.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.037 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.634 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 28.0 t-20 55.36 54.5 9.71 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.164 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.634 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 69.7 Cg_endo -101.25 -160.15 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 124.071 3.181 . . . . 0.0 111.596 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.19 140.44 50.19 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.834 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.7 133.57 36.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.316 0.579 . . . . 0.0 111.477 -178.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -156.36 132.11 9.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.989 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.18 108.86 13.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.876 0.369 . . . . 0.0 111.396 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.469 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.61 110.8 22.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.938 179.047 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 66.2 t30 59.64 43.9 15.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.857 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.6 t0 72.4 13.29 5.54 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.279 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.416 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.08 128.44 55.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.777 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.673 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -60.98 108.65 0.9 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.041 0.448 . . . . 0.0 110.519 179.838 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.547 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 24.7 m80 -122.8 132.82 54.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.211 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.639 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.0 OUTLIER -108.51 123.77 49.41 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.788 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.583 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER -171.82 169.69 5.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.556 0.693 . . . . 0.0 112.762 -178.735 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.817 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -129.19 168.92 15.46 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.341 178.401 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.44 105.78 7.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.064 0.459 . . . . 0.0 110.9 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.448 ' CG ' HG22 ' A' ' 464' ' ' THR . 39.3 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.918 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . 0.53 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 120.813 0.339 . . . . 0.0 111.566 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -53.45 -55.16 27.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.077 0.465 . . . . 0.0 111.561 -179.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -80.01 -21.81 43.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.235 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 1.021 ' CD1' HD21 ' A' ' 474' ' ' LEU . 39.1 tp -48.63 -29.54 4.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.299 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . 0.527 HG23 ' OE1' ' B' ' 594' ' ' GLU . 79.1 mt -85.61 -29.77 6.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.216 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.574 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.48 -52.13 65.77 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.15 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.806 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -66.51 -17.94 65.09 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.497 -179.612 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.527 ' OE1' HG23 ' B' ' 591' ' ' ILE . 1.0 OUTLIER -62.28 -30.87 71.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.968 -179.682 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.403 ' CG ' ' O ' ' B' ' 592' ' ' TYR . 1.6 pt-20 -82.52 -43.73 16.79 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.591 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -53.86 -26.5 14.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.097 0.475 . . . . 0.0 111.172 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.909 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.6 tp -71.1 -82.65 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.557 0.694 . . . . 0.0 112.041 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.669 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.4 m . . . . . 0 N--CA 1.438 -1.073 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.627 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.789 HG22 ' CD2' ' A' ' 477' ' ' PHE . 59.3 t . . . . . 0 CA--C 1.516 -0.36 0 CA-C-O 120.844 0.355 . . . . 0.0 110.648 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.446 ' O ' HG23 ' A' ' 459' ' ' VAL . 25.4 p -131.65 163.36 28.28 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.642 0.734 . . . . 0.0 112.503 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.787 ' HA ' HG23 ' A' ' 496' ' ' ILE . 22.3 mt-10 -58.56 -52.57 65.1 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.51 -1.223 . . . . 0.0 110.933 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.03 -27.49 68.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.581 -178.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.474 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -70.07 -58.18 4.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.738 0.304 . . . . 0.0 111.62 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.918 ' HB ' HD21 ' A' ' 500' ' ' LEU . 16.9 t -48.17 -31.72 3.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.946 0.403 . . . . 0.0 110.9 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.572 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -54.69 -47.99 72.98 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.259 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -63.35 -27.88 69.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.507 179.452 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.512 ' CE2' ' CE2' ' A' ' 477' ' ' PHE . 8.2 m-30 -68.78 -42.9 76.76 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.289 0.566 . . . . 0.0 109.649 178.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.089 HD11 HD13 ' A' ' 500' ' ' LEU . 3.7 mt -70.35 -60.29 2.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.964 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.661 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.1 OUTLIER -49.44 -24.43 1.99 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.065 -179.569 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -92.93 -46.04 7.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.508 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.489 ' HD2' ' HD2' ' A' ' 467' ' ' PRO . 1.4 mmmt -165.2 128.8 1.67 Allowed Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.005 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.564 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 18.0 Cg_endo -56.17 146.09 72.85 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.358 2.039 . . . . 0.0 112.716 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.629 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -132.78 178.23 7.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.278 -179.276 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.571 HG22 ' O ' ' A' ' 511' ' ' MET . 10.1 p -124.16 160.71 27.24 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.094 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.586 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.7 OUTLIER -58.22 -30.84 66.82 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.192 -0.603 . . . . 0.0 111.251 -179.174 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 1.012 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -76.53 -50.84 12.93 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.823 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . 0.432 ' HA ' ' CD ' ' A' ' 475' ' ' LYS . 11.9 t70 -64.79 -31.04 72.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.86 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.767 HD13 HD11 ' A' ' 493' ' ' LEU . 0.5 OUTLIER -60.13 -42.36 94.62 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.164 0.507 . . . . 0.0 110.985 -179.558 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 1.021 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.9 pp -85.24 -25.03 27.53 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.555 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.477 ' HD2' ' O ' ' A' ' 471' ' ' LYS . 4.1 mttt -46.05 -36.32 5.62 Favored 'General case' 0 N--CA 1.461 0.109 0 N-CA-C 111.628 0.232 . . . . 0.0 111.628 -178.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.527 ' HE3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -93.43 -43.23 8.85 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.135 179.573 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.789 ' CD2' HG22 ' A' ' 454' ' ' VAL . 3.0 m-85 . . . . . 0 N--CA 1.45 -0.44 0 CA-C-O 121.381 0.61 . . . . 0.0 110.158 179.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 1.004 HD23 HG11 ' A' ' 492' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.448 -0.562 0 CA-C-O 121.107 0.479 . . . . 0.0 111.407 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.51 161.09 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.496 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 98.9 p -60.89 -24.98 66.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.021 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -91.02 -43.51 9.89 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.349 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.663 ' O ' HG12 ' A' ' 492' ' ' VAL . 2.0 mt-30 -64.08 -41.24 97.39 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.918 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 91.8 m -51.75 -27.7 12.9 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.714 178.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.783 HG22 HD22 ' A' ' 474' ' ' LEU . 6.6 t -84.94 -40.37 14.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.813 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -61.09 -32.0 71.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.911 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 1.004 HG11 HD23 ' A' ' 484' ' ' LEU . 7.7 p -94.01 -11.15 9.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.752 179.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.767 HD11 HD13 ' A' ' 473' ' ' LEU . 21.8 tp -89.85 -43.04 10.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.216 0.531 . . . . 0.0 110.204 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.573 ' HB2' ' HB2' ' B' ' 593' ' ' LEU . . . -51.97 -33.54 38.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.658 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.23 -42.88 79.11 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.891 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.787 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.9 mt -72.86 -45.28 56.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -178.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.909 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.7 OUTLIER -37.38 -64.01 0.4 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.6 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.591 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.61 -27.06 65.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.991 0.424 . . . . 0.0 111.261 -179.282 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.71 -26.5 68.7 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.547 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.089 HD13 HD11 ' A' ' 463' ' ' LEU . 67.3 mt -60.36 -47.37 86.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.918 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.56 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 59.12 59.69 5.13 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.732 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.56 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 91.7 Cg_endo -101.19 -159.25 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.326 0 C-N-CA 124.04 3.16 . . . . 0.0 111.317 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.39 141.53 48.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.738 178.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -79.47 134.23 36.53 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.321 0.581 . . . . 0.0 111.292 -179.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -156.12 157.95 36.87 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.857 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.441 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.8 OUTLIER -105.19 109.94 22.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.93 0.395 . . . . 0.0 111.532 -179.757 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.488 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.72 110.79 22.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.867 178.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 59.51 44.41 14.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.739 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 6.5 t0 71.16 13.83 6.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.257 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.45 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.15 134.69 54.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.784 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.571 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -65.78 108.74 2.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.937 0.399 . . . . 0.0 110.88 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.508 ' CE1' ' CG2' ' A' ' 469' ' ' THR . 25.6 m80 -123.05 130.7 53.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.093 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.63 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -105.0 125.44 50.98 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.092 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.564 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER -175.29 169.33 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.78 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.703 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.2 pt? -122.74 169.14 11.38 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.062 178.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.79 106.75 8.31 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.434 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.661 ' HG2' HG22 ' A' ' 464' ' ' THR . 6.1 pt-20 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.044 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . 0.412 ' O ' ' HB3' ' B' ' 590' ' ' LEU . 1.1 p30 . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.814 0.34 . . . . 0.0 111.554 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -57.51 -40.8 79.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.899 0.381 . . . . 0.0 111.413 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.411 ' CE1' ' HG3' ' A' ' 487' ' ' GLU . 2.1 p-80 -80.32 -21.87 42.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.724 -179.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.938 ' CD1' HD21 ' A' ' 474' ' ' LEU . 16.6 tp -53.5 -31.05 44.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.957 0.408 . . . . 0.0 110.72 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.7 mt -85.76 -29.59 6.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.892 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.578 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.42 -38.74 92.1 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.809 -179.441 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.824 HD13 ' N ' ' B' ' 594' ' ' GLU . 0.0 OUTLIER -78.39 -18.0 55.65 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.191 0.52 . . . . 0.0 109.988 -179.887 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.824 ' N ' HD13 ' B' ' 593' ' ' LEU . 1.1 pt-20 -62.37 -30.75 71.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.844 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 7.5 pt-20 -82.2 -48.49 11.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.316 -179.101 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.734 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -52.39 -26.8 9.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.22 0.533 . . . . 0.0 111.211 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.994 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.8 tp -60.87 -84.86 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.343 -0.844 . . . . 0.0 113.027 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.739 HG13 ' HG ' ' B' ' 597' ' ' LEU . 34.8 m . . . . . 0 N--CA 1.436 -1.156 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.679 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.866 HG22 ' CD2' ' A' ' 477' ' ' PHE . 93.1 t . . . . . 0 CA--C 1.516 -0.349 0 CA-C-O 120.878 0.37 . . . . 0.0 110.564 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.473 ' O ' HG23 ' A' ' 459' ' ' VAL . 23.6 p -131.49 163.66 27.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.634 0.73 . . . . 0.0 112.361 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.809 ' HA ' HG23 ' A' ' 496' ' ' ILE . 21.7 mt-10 -57.99 -53.08 62.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.67 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.49 -28.09 68.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.0 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -67.51 -58.07 5.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.828 0.346 . . . . 0.0 111.36 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.86 ' HB ' HD21 ' A' ' 500' ' ' LEU . 21.2 t -50.58 -28.83 6.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.581 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.508 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.9 OUTLIER -58.5 -45.49 88.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.978 0.418 . . . . 0.0 110.434 179.036 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.439 ' HG2' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -60.87 -25.38 66.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.929 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.525 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 8.8 m-30 -77.83 -39.74 42.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.832 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.827 HD11 HD22 ' A' ' 500' ' ' LEU . 0.9 OUTLIER -70.08 -61.4 1.79 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.233 179.914 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.751 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.1 OUTLIER -48.37 -27.27 2.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.093 0.473 . . . . 0.0 110.563 179.783 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 45.1 ttp180 -87.1 -50.32 6.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.907 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.419 ' HD2' ' HD2' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -167.46 128.28 1.18 Allowed Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.612 -179.839 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.621 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 9.0 Cg_endo -48.78 169.7 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.234 1.956 . . . . 0.0 112.502 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.523 ' SD ' HD22 ' A' ' 463' ' ' LEU . 0.0 OUTLIER -156.42 -178.55 7.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.601 0.715 . . . . 0.0 111.88 -178.801 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.818 HG23 ' ND1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -119.84 170.61 9.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.59 -1.186 . . . . 0.0 107.818 177.744 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.509 HG23 HD22 ' B' ' 597' ' ' LEU . 0.6 OUTLIER -71.15 -32.86 69.47 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.074 -0.65 . . . . 0.0 110.612 179.682 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.785 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -76.86 -46.66 23.79 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.461 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -64.25 -20.53 66.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.534 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.758 HD12 HD11 ' A' ' 497' ' ' LEU . 4.8 mt -78.39 -37.23 44.53 Favored 'General case' 0 C--N 1.334 -0.081 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.998 HD22 HG22 ' A' ' 490' ' ' VAL . 1.4 pp -82.46 -49.51 9.86 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.132 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.616 ' N ' HD12 ' A' ' 474' ' ' LEU . 16.1 mmtp -46.72 -28.84 1.64 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -75.76 -43.0 48.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.921 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.866 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.5 m-85 . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.475 0.655 . . . . 0.0 110.294 179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 1.005 HD23 HG11 ' A' ' 492' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.458 0 CA-C-O 120.953 0.406 . . . . 0.0 111.096 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.12 160.82 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.532 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . 0.412 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.2 OUTLIER -59.85 -23.93 63.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.162 0.506 . . . . 0.0 109.741 178.558 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.411 ' HG3' ' CE1' ' B' ' 589' ' ' HIS . 10.5 tt0 -89.77 -51.4 5.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.167 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.721 ' O ' HG12 ' A' ' 492' ' ' VAL . 0.8 OUTLIER -59.06 -41.68 88.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.019 179.386 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 91.9 m -50.61 -30.5 13.5 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.715 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.998 HG22 HD22 ' A' ' 474' ' ' LEU . 3.4 t -82.57 -40.59 16.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.184 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -60.37 -30.74 69.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.962 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 1.005 HG11 HD23 ' A' ' 484' ' ' LEU . 5.6 p -99.01 -6.94 9.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.835 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.781 HD11 HD22 ' A' ' 497' ' ' LEU . 13.8 tp -94.29 -40.79 9.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.032 0.444 . . . . 0.0 110.557 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.693 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -54.67 -38.02 66.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.442 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.489 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.59 -41.92 95.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.935 -179.286 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.809 HG23 ' HA ' ' A' ' 456' ' ' GLU . 13.7 mt -77.75 -48.17 24.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.994 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -31.58 -64.05 0.16 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.487 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.734 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -60.18 -29.82 68.95 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.415 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -55.52 -23.3 25.57 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.971 0.415 . . . . 0.0 111.036 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.86 HD21 ' HB ' ' A' ' 459' ' ' VAL . 16.0 mt -63.1 -47.45 82.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.654 -179.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.558 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 60.68 59.83 3.65 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.013 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.558 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 53.1 Cg_endo -99.78 -159.24 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 123.983 3.122 . . . . 0.0 111.6 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.55 140.19 51.83 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.828 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.59 134.89 36.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.369 0.604 . . . . 0.0 111.713 -178.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -156.22 160.08 39.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.588 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.56 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 8.6 ptm -97.79 109.95 22.61 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.137 0.494 . . . . 0.0 111.589 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.552 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.3 OUTLIER -90.63 110.92 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.852 179.103 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 60.37 38.77 19.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.719 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . 0.56 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 5.2 t70 77.86 10.15 2.21 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.573 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.447 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.24 134.23 55.14 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.619 0.247 . . . . 0.0 111.088 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.459 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.04 108.61 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.098 0.475 . . . . 0.0 111.004 -179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.818 ' ND1' HG23 ' A' ' 469' ' ' THR . 2.2 m80 -122.62 148.37 45.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.436 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.628 ' CZ ' HD23 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -126.1 123.31 38.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.245 179.666 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.769 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.3 OUTLIER -176.68 169.3 2.54 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.142 0.496 . . . . 0.0 111.945 -179.129 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.765 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.6 pt? -114.24 169.15 9.24 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.404 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.419 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -142.35 106.43 4.74 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.029 0.443 . . . . 0.0 111.378 179.683 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.751 ' HB2' HG22 ' A' ' 464' ' ' THR . 28.6 mm-40 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.826 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 120.742 0.306 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.87 -47.28 64.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.962 0.411 . . . . 0.0 111.376 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.425 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 2.1 p-80 -80.07 -21.85 42.93 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.238 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.907 ' CD1' HD21 ' A' ' 474' ' ' LEU . 26.1 tp -62.95 -43.61 98.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.793 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . 0.408 ' O ' ' HB3' ' B' ' 594' ' ' GLU . 51.3 mt -86.13 -29.55 6.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 120.813 0.34 . . . . 0.0 111.009 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.567 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -63.28 -44.97 93.55 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.643 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 1.039 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -69.69 -19.72 63.57 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.38 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.721 ' N ' HD13 ' B' ' 593' ' ' LEU . 10.6 tt0 -63.13 -30.86 71.93 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.337 179.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.32 -44.45 62.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.495 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 1.05 HD11 ' HB1' ' A' ' 494' ' ' ALA . 4.8 pt -58.17 -26.64 30.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.184 0.516 . . . . 0.0 110.963 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.825 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.0 tp -72.73 -81.78 0.05 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.04 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.708 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.0 m . . . . . 0 N--CA 1.438 -1.054 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.731 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.468 HG22 ' CE2' ' A' ' 477' ' ' PHE . 0.9 OUTLIER . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 120.964 0.412 . . . . 0.0 110.796 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.559 ' O ' HG23 ' A' ' 459' ' ' VAL . 27.4 p -131.65 169.87 15.55 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.557 0.694 . . . . 0.0 112.654 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.596 ' HA ' HG23 ' A' ' 496' ' ' ILE . 20.6 mt-10 -69.13 -54.7 13.59 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.271 179.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.96 -26.76 6.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.758 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.431 ' O ' ' CD1' ' A' ' 462' ' ' TYR . . . -77.16 -35.54 55.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.85 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.779 HG13 HD11 ' A' ' 473' ' ' LEU . 4.0 t -76.1 -40.15 36.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.876 0.37 . . . . 0.0 111.392 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.571 ' CD ' HD23 ' A' ' 500' ' ' LEU . 1.6 mmm180 -53.99 -39.24 65.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.254 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.449 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -70.8 -28.83 64.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.614 179.334 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.449 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 14.2 m-30 -65.69 -36.95 85.1 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.084 HD11 HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -74.27 -55.96 5.44 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.838 179.718 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.815 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -50.48 -25.36 3.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.679 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 466' ' ' LYS . 24.6 ptt180 -92.99 -39.45 11.1 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.223 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -176.73 132.24 0.38 Allowed Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 120.72 0.295 . . . . 0.0 111.044 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.585 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 18.0 Cg_endo -58.06 152.47 51.48 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.752 2.301 . . . . 0.0 113.41 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.843 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.09 161.36 42.51 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.507 -179.505 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.765 HG22 ' O ' ' A' ' 511' ' ' MET . 11.6 p -96.62 -178.41 4.25 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 1.039 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -71.06 -44.71 65.2 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.687 -0.805 . . . . 0.0 110.88 179.593 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.823 ' HB3' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -62.32 -51.88 65.88 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.995 179.284 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . 0.413 ' H ' ' HG2' ' A' ' 471' ' ' LYS . 36.4 t70 -57.85 -26.71 62.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.388 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.843 HD12 ' CG ' ' A' ' 468' ' ' MET . 1.0 OUTLIER -83.05 -41.52 18.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.104 0.478 . . . . 0.0 111.37 -179.654 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.975 ' HB3' HD23 ' A' ' 493' ' ' LEU . 2.6 pp -83.98 -25.94 29.62 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -178.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.491 ' HD2' ' HB2' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -48.24 -33.59 8.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.685 0.279 . . . . 0.0 111.607 -178.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.482 ' HE2' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -87.5 -43.11 12.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.41 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.482 ' CD2' ' HE2' ' A' ' 476' ' ' LYS . 3.8 m-85 . . . . . 0 N--CA 1.454 -0.242 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 179.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.401 ' HB3' ' OG1' ' A' ' 489' ' ' THR . 0.4 OUTLIER . . . . . 0 N--CA 1.451 -0.385 0 CA-C-O 120.857 0.361 . . . . 0.0 111.058 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.42 150.83 0.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.916 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . 0.479 ' O ' HG23 ' A' ' 490' ' ' VAL . 6.3 t -61.43 -23.09 65.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.373 179.233 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 7.9 mt-10 -90.94 -48.44 7.0 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.598 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -45.18 94.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.257 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 91.1 m -49.56 -35.37 20.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.132 179.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.694 HG13 HD22 ' A' ' 474' ' ' LEU . 2.2 t -75.75 -44.1 39.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.078 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.15 -26.2 49.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.082 179.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.46 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 8.7 p -102.17 -15.29 7.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.085 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.975 HD23 ' HB3' ' A' ' 474' ' ' LEU . 1.8 tp -89.04 -42.52 11.7 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.106 0.479 . . . . 0.0 110.823 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 1.05 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -51.29 -37.12 45.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.604 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.46 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.33 -37.88 89.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.668 -179.506 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.596 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.0 mt -78.73 -42.52 25.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.825 ' HB3' HD13 ' B' ' 597' ' ' LEU . 3.2 mm? -41.83 -50.4 4.39 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.832 ' NZ ' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -61.18 -25.62 67.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.834 0.349 . . . . 0.0 111.593 -179.157 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.484 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 9.1 mmp_? -64.16 -19.04 65.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.969 0.414 . . . . 0.0 110.478 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.084 HD22 HD11 ' A' ' 463' ' ' LEU . 64.8 mt -62.13 -47.48 84.4 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.839 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.614 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.3 t-20 54.66 57.08 11.95 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.334 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.614 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 83.1 Cg_endo -102.24 -159.75 0.04 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.454 0 C-N-CA 123.967 3.111 . . . . 0.0 111.672 -179.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.05 140.44 51.0 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.659 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . 0.447 ' HB2' ' HE1' ' A' ' 511' ' ' MET . 35.4 ptt85 -79.52 134.59 36.5 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.342 0.591 . . . . 0.0 111.435 -178.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt -156.02 160.26 39.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.757 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.492 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 8.3 ptm -103.72 110.23 22.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.941 0.4 . . . . 0.0 111.555 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.543 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.68 110.88 22.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.882 179.011 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 56.0 t30 59.7 40.52 19.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.685 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . 0.492 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 0.6 OUTLIER 75.7 12.54 3.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.373 -180.0 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.425 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.18 131.76 56.85 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.619 0.247 . . . . 0.0 111.003 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.765 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -61.67 108.7 1.03 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.057 0.456 . . . . 0.0 110.69 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.588 ' CE1' HG23 ' A' ' 469' ' ' THR . 9.1 m80 -122.6 131.4 53.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.063 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.659 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.1 OUTLIER -109.81 123.75 50.1 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.848 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.616 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.5 OUTLIER -179.23 169.11 1.5 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.22 0.533 . . . . 0.0 112.236 -178.858 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.705 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.4 pt? -119.33 169.23 10.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.44 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.423 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -139.26 106.3 5.45 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.987 0.422 . . . . 0.0 111.264 179.541 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.815 ' HB2' HG22 ' A' ' 464' ' ' THR . 4.4 mm-40 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.769 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . 0.648 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 120.75 0.309 . . . . 0.0 111.459 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -53.8 -55.14 29.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.09 0.472 . . . . 0.0 111.367 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.4 ' HA ' ' HB3' ' B' ' 592' ' ' TYR . 1.1 p-80 -80.15 -21.88 42.62 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.224 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.911 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.7 tp -48.33 -33.79 9.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.128 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 68.4 mt -85.89 -29.65 6.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.86 0.362 . . . . 0.0 110.512 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.55 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -63.7 -40.38 96.65 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.15 179.906 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.811 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -80.16 -18.15 50.51 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.267 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.683 ' N ' HD13 ' B' ' 593' ' ' LEU . 71.0 tt0 -63.06 -30.91 71.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.863 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 9.6 pt-20 -80.63 -48.06 13.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.164 -179.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.677 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -52.2 -26.63 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.168 0.508 . . . . 0.0 110.893 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.923 HD22 ' HG ' ' A' ' 497' ' ' LEU . 13.4 tp -69.53 -82.65 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.936 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.684 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 30.8 m . . . . . 0 N--CA 1.436 -1.138 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.319 -177.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.842 HG22 ' CE2' ' A' ' 477' ' ' PHE . 1.4 t . . . . . 0 CA--C 1.519 -0.244 0 CA-C-O 120.926 0.393 . . . . 0.0 110.955 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.579 ' O ' HG23 ' A' ' 459' ' ' VAL . 33.1 p -131.56 169.12 16.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.609 0.718 . . . . 0.0 112.537 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.698 ' HA ' HG23 ' A' ' 496' ' ' ILE . 26.6 mt-10 -69.24 -53.49 19.6 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.591 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.66 -27.87 59.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.158 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -73.98 -32.36 63.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.589 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.773 ' HB ' HD21 ' A' ' 500' ' ' LEU . 10.2 t -76.02 -36.72 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.864 0.364 . . . . 0.0 111.091 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.625 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -54.9 -46.05 74.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.123 179.106 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.441 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.2 OUTLIER -64.25 -26.15 68.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.793 179.486 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.532 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 18.0 m-30 -72.02 -36.31 69.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.141 179.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.862 HD11 HD22 ' A' ' 500' ' ' LEU . 1.3 mt -75.33 -59.39 2.77 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.186 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.538 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -46.11 -27.41 0.95 Allowed 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.555 179.827 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -85.77 -52.85 5.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.784 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.451 ' HG3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -167.57 135.4 1.96 Allowed Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.575 -179.756 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.574 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 33.2 Cg_exo -53.74 176.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.014 1.809 . . . . 0.0 113.02 -179.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.99 ' HG2' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -164.73 171.76 13.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.878 -177.439 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.66 HG22 ' CD2' ' A' ' 512' ' ' HIS . 1.4 p -112.21 157.95 20.28 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 177.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.608 HG23 HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.17 -39.98 84.18 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.24 -0.584 . . . . 0.0 110.569 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.843 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -65.74 -50.91 63.07 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.765 178.942 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -62.9 -22.21 66.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.418 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.99 HD21 ' HG2' ' A' ' 468' ' ' MET . 10.7 mt -76.65 -46.26 26.56 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.911 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.5 OUTLIER -73.27 -50.7 20.82 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.761 0.315 . . . . 0.0 111.199 -179.169 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.664 ' HD3' HD12 ' A' ' 474' ' ' LEU . 23.8 mmtt -52.11 -25.19 8.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.185 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.632 ' HE2' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -70.47 -43.99 68.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.853 0.358 . . . . 0.0 110.499 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.842 ' CE2' HG22 ' A' ' 454' ' ' VAL . 15.5 m-85 . . . . . 0 CA--C 1.511 -0.555 0 CA-C-O 121.867 0.842 . . . . 0.0 109.874 179.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 1.066 HD23 HG11 ' A' ' 492' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.448 0 CA-C-O 120.996 0.427 . . . . 0.0 111.366 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.13 161.13 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.589 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 23.4 p -60.18 -25.15 65.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.077 0.465 . . . . 0.0 109.951 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -90.45 -46.3 8.43 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.422 179.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.665 ' O ' HG12 ' A' ' 492' ' ' VAL . 0.7 OUTLIER -62.21 -41.95 98.84 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.889 179.467 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 88.6 m -50.76 -29.31 11.15 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.547 HG13 HD22 ' A' ' 474' ' ' LEU . 3.2 t -83.93 -41.14 16.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.293 179.264 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.58 -28.21 65.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.321 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 1.066 HG11 HD23 ' A' ' 484' ' ' LEU . 4.4 p -101.58 -7.57 9.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.957 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.786 HD23 ' HB3' ' A' ' 474' ' ' LEU . 3.4 tp -95.11 -35.89 11.72 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.943 0.402 . . . . 0.0 110.784 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.607 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -58.92 -38.99 80.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.175 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.472 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -66.64 -41.6 88.02 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.825 -179.338 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.698 HG23 ' HA ' ' A' ' 456' ' ' GLU . 12.7 mt -81.05 -30.07 11.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.923 ' HG ' HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -49.36 -56.93 7.91 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -178.622 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.677 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -61.86 -28.94 69.85 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -177.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.522 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 16.7 mmm180 -55.05 -22.16 14.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.059 0.457 . . . . 0.0 110.714 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.862 HD22 HD11 ' A' ' 463' ' ' LEU . 50.0 mt -63.15 -48.01 80.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.291 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.597 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.9 t-20 55.18 57.36 11.04 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.898 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.597 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 58.2 Cg_endo -100.36 -160.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.222 0 C-N-CA 124.083 3.189 . . . . 0.0 111.66 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.47 140.33 51.57 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.705 178.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -79.55 135.69 36.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.377 0.608 . . . . 0.0 111.535 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -154.69 147.46 24.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.747 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.44 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 6.9 ptm -90.14 108.77 19.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.011 0.434 . . . . 0.0 111.77 -179.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.436 ' N ' ' O ' ' A' ' 510' ' ' LYS . 0.6 OUTLIER -92.7 110.77 23.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.884 178.872 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 59.63 40.39 20.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.932 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . 0.44 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 6.6 m-20 77.11 10.31 2.55 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.524 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.446 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.6 tpmt? -116.09 131.83 56.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.594 0.235 . . . . 0.0 110.679 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 6.6 tpt -66.61 108.42 2.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.119 0.485 . . . . 0.0 111.052 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.66 ' CD2' HG22 ' A' ' 469' ' ' THR . 12.1 m170 -122.74 137.9 54.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.225 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.597 ' CE1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -118.54 122.97 43.95 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.698 0.285 . . . . 0.0 110.721 179.652 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.574 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -168.95 169.8 9.42 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.196 0.522 . . . . 0.0 111.993 -179.302 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.769 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.3 pt? -111.01 169.09 9.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.401 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -135.37 106.65 6.78 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.389 -0.524 . . . . 0.0 111.59 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.538 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.105 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' B' ' 589' ' ' HIS . 39.0 p-10 -50.75 -51.53 49.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.879 0.371 . . . . 0.0 111.843 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.42 ' N ' ' OD1' ' B' ' 588' ' ' ASP . 1.8 p-80 -80.52 -21.96 41.36 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.327 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.985 ' CD1' HD21 ' A' ' 474' ' ' LEU . 31.6 tp -54.69 -33.86 61.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.007 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 83.2 mt -85.85 -29.62 6.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.896 0.379 . . . . 0.0 110.818 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.19 -40.72 96.7 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.382 -179.818 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.806 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.91 -18.11 54.41 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.107 0.48 . . . . 0.0 110.211 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.743 ' N ' HD13 ' B' ' 593' ' ' LEU . 79.8 tt0 -62.78 -32.66 73.86 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.001 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 8.0 pt-20 -79.5 -47.43 15.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.355 -179.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.692 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.0 pp -51.45 -26.7 6.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 120.965 0.412 . . . . 0.0 111.276 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.853 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.8 tp -69.87 -83.04 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.492 0.663 . . . . 0.0 111.435 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.673 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m . . . . . 0 N--CA 1.437 -1.083 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.527 -178.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.533 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.3 t . . . . . 0 CA--C 1.517 -0.311 0 CA-C-O 121.036 0.446 . . . . 0.0 111.126 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.569 ' O ' HG23 ' A' ' 459' ' ' VAL . 28.4 p -132.1 163.0 29.44 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.516 0.674 . . . . 0.0 112.285 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.57 ' HA ' HG23 ' A' ' 496' ' ' ILE . 15.9 mt-10 -59.35 -54.53 45.74 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.126 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -28.25 19.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.777 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -77.65 -35.42 52.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.777 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.839 ' CG1' HD21 ' A' ' 500' ' ' LEU . 6.1 t -76.18 -34.85 26.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.684 0.278 . . . . 0.0 111.743 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.562 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.2 mmm180 -59.82 -37.22 78.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.643 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.3 OUTLIER -68.95 -31.75 70.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.138 179.313 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.478 ' O ' ' O ' ' A' ' 466' ' ' LYS . 14.7 m-30 -62.17 -45.01 95.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.095 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.033 HD11 HD22 ' A' ' 500' ' ' LEU . 0.3 OUTLIER -65.9 -59.23 4.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.09 179.774 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.76 HG22 ' CG ' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -49.24 -25.26 2.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.032 0.444 . . . . 0.0 110.424 179.639 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.581 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 45.5 ttt180 -90.98 -31.19 16.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.134 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.674 ' HE2' ' HD3' ' A' ' 467' ' ' PRO . 0.0 OUTLIER 167.15 167.91 0.11 Allowed Pre-proline 0 CA--C 1.532 0.253 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.592 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.714 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 84.5 Cg_endo -74.43 160.87 41.15 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.283 1.989 . . . . 0.0 114.113 -178.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.724 ' SD ' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.56 159.33 44.57 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 114.999 -1.001 . . . . 0.0 111.005 -179.008 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.685 ' O ' HD12 ' A' ' 473' ' ' LEU . 17.4 p -108.45 163.41 13.24 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.514 HG21 ' HA ' ' B' ' 594' ' ' GLU . 0.7 OUTLIER -64.63 -36.76 85.29 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.672 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.872 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -72.97 -50.22 24.61 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.42 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -61.12 -26.2 67.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.474 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.836 HD13 HD11 ' A' ' 497' ' ' LEU . 0.4 OUTLIER -69.1 -46.56 67.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.027 0.441 . . . . 0.0 111.152 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 1.083 HD22 HG22 ' A' ' 490' ' ' VAL . 2.1 pp -84.19 -31.87 24.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.589 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.52 -29.69 2.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.84 0.352 . . . . 0.0 110.922 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.481 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -93.12 -35.17 13.33 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.929 179.625 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.533 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.2 m-85 . . . . . 0 CA--C 1.531 0.243 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.867 HD21 HG11 ' A' ' 492' ' ' VAL . 6.1 tp . . . . . 0 N--CA 1.449 -0.484 0 CA-C-O 120.967 0.413 . . . . 0.0 110.983 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.37 145.81 0.16 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.888 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 3.1 t -58.29 -22.56 53.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.726 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -91.52 -48.75 6.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.716 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.735 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.0 OUTLIER -63.05 -38.7 92.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.872 179.524 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.413 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 96.7 m -51.69 -30.08 20.64 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 1.083 HG22 HD22 ' A' ' 474' ' ' LEU . 4.6 t -82.72 -40.07 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.087 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -60.53 -29.99 69.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.057 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.867 HG11 HD21 ' A' ' 484' ' ' LEU . 4.3 p -100.59 -6.98 9.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.94 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.688 ' CD1' HD22 ' A' ' 497' ' ' LEU . 16.7 tp -93.61 -40.17 10.42 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.073 0.463 . . . . 0.0 110.373 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.611 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -53.96 -42.12 68.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.381 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.507 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -62.47 -40.16 95.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.975 -179.328 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.57 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.2 mt -78.52 -41.67 25.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 112.559 0.578 . . . . 0.0 112.559 -178.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.853 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -37.66 -58.73 0.86 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.524 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.692 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.44 -22.98 62.28 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.369 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.479 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 0.8 OUTLIER -63.56 -18.75 64.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 0.0 110.457 179.133 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.033 HD22 HD11 ' A' ' 463' ' ' LEU . 34.0 mt -62.69 -47.78 82.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.434 -179.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.647 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 28.0 t-20 55.22 54.52 9.94 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.197 -179.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.647 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 61.2 Cg_endo -101.72 -161.0 0.04 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 124.209 3.272 . . . . 0.0 111.712 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.76 139.87 51.62 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.565 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . 0.447 ' HB2' ' HE1' ' A' ' 511' ' ' MET . 30.1 ptt180 -79.53 132.45 36.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.451 0.643 . . . . 0.0 111.553 -178.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -156.27 130.07 8.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.841 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.407 ' HE2' ' HB2' ' A' ' 506' ' ' MET . 0.1 OUTLIER -76.47 112.29 12.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.908 0.385 . . . . 0.0 111.535 -179.605 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.445 ' HB ' ' ND1' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.52 122.54 42.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.655 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . 0.405 ' ND2' HG22 ' A' ' 507' ' ' ILE . 18.6 p30 48.91 37.56 10.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.436 -179.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . 0.404 ' CB ' ' O ' ' A' ' 508' ' ' ASN . 12.6 t70 80.12 13.03 0.97 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.563 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.431 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -116.28 131.48 56.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.594 179.715 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.469 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -62.05 108.29 1.02 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.087 0.47 . . . . 0.0 110.635 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.566 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 28.6 m80 -123.26 127.87 49.19 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.861 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.63 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.0 OUTLIER -104.92 123.73 48.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.803 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.714 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -178.33 169.47 1.82 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.407 0.622 . . . . 0.0 112.276 -178.756 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.794 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -122.82 168.96 11.6 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.337 178.56 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.97 106.06 8.4 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.207 0.527 . . . . 0.0 111.178 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.76 ' CG ' HG22 ' A' ' 464' ' ' THR . 2.4 pt-20 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.178 -0.915 . . . . 0.0 111.0 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.261 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -53.96 -55.11 30.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.008 0.432 . . . . 0.0 111.601 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.407 ' CE1' ' HB3' ' A' ' 487' ' ' GLU . 1.2 p-80 -77.49 -21.91 52.06 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.041 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.918 ' CD1' HD21 ' A' ' 474' ' ' LEU . 26.3 tp -58.47 -37.94 76.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.733 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 64.7 mt -86.01 -29.81 6.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.905 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.571 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.32 -40.83 86.0 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-O 121.063 0.459 . . . . 0.0 110.992 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.905 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -80.14 -18.16 50.55 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.957 179.781 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.797 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.1 OUTLIER -63.41 -32.5 73.95 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.614 179.605 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 7.7 pt-20 -78.93 -46.87 17.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.385 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.727 HD11 ' HB1' ' A' ' 494' ' ' ALA . 1.6 pp -50.76 -26.63 4.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.09 0.471 . . . . 0.0 110.911 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.897 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.2 tp -71.65 -82.58 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.618 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.681 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m . . . . . 0 N--CA 1.439 -1.023 0 CA-C-N 114.59 -1.187 . . . . 0.0 110.66 -177.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.612 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.3 t . . . . . 0 CA--C 1.519 -0.232 0 CA-C-O 120.893 0.378 . . . . 0.0 110.682 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.488 ' O ' HG23 ' A' ' 459' ' ' VAL . 33.4 p -131.67 172.89 11.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.704 0.764 . . . . 0.0 112.489 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.711 ' HA ' HG23 ' A' ' 496' ' ' ILE . 18.2 mt-10 -69.18 -53.26 20.93 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.463 179.237 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -28.46 64.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.955 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.442 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -70.55 -34.34 72.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.569 -179.507 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.802 HG13 HD11 ' A' ' 473' ' ' LEU . 18.6 t -76.15 -37.46 32.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.768 0.318 . . . . 0.0 111.369 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.795 ' O ' HG23 ' A' ' 464' ' ' THR . 1.7 mmm-85 -54.49 -44.57 72.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.073 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.497 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -62.83 -29.25 70.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.446 179.4 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.497 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 10.5 m-30 -68.94 -44.63 72.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.114 0.483 . . . . 0.0 109.909 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.013 HD11 HD22 ' A' ' 500' ' ' LEU . 0.7 OUTLIER -67.31 -59.78 3.13 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.224 -179.858 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.795 HG23 ' O ' ' A' ' 460' ' ' ARG . 17.9 p -47.34 -27.38 1.59 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.009 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.4 mtp85 -88.68 -40.76 13.04 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.015 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.487 ' HD2' ' O ' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -175.96 146.39 0.82 Allowed Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.913 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.673 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 39.9 Cg_endo -65.02 151.76 84.68 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.66 2.24 . . . . 0.0 113.115 -179.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.751 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -147.7 163.83 35.46 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.338 0.589 . . . . 0.0 112.072 -179.317 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.625 HG22 ' O ' ' A' ' 511' ' ' MET . 3.0 p -107.62 160.68 15.51 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.177 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.905 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -53.26 -46.65 69.31 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.865 -179.641 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.867 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -58.97 -57.02 14.91 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.03 179.287 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -60.57 -26.73 67.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.759 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.802 HD11 HG13 ' A' ' 459' ' ' VAL . 1.5 tt -77.92 -43.9 28.59 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.02 0.438 . . . . 0.0 111.498 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.918 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.9 pp -84.07 -32.9 24.55 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.251 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.413 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.1 OUTLIER -50.54 -33.4 21.53 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.801 0.334 . . . . 0.0 111.433 -179.428 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -75.21 -42.02 56.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.338 -179.681 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.612 ' CE2' HG22 ' A' ' 454' ' ' VAL . 12.4 m-85 . . . . . 0 N--CA 1.454 -0.249 0 CA-C-O 121.035 0.445 . . . . 0.0 110.997 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.411 ' CD2' HG11 ' A' ' 492' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.45 -0.454 0 CA-C-O 120.98 0.419 . . . . 0.0 111.001 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.22 149.92 0.47 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.561 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . 0.593 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.7 OUTLIER -58.47 -23.31 57.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.176 178.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . 0.407 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 15.5 mt-10 -86.53 -55.06 4.05 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.613 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -60.0 -40.72 90.19 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.241 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.417 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 97.7 m -50.55 -33.37 21.53 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 486' ' ' SER . 4.5 t -76.82 -42.68 33.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.873 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -57.19 -25.97 59.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.391 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.526 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 8.0 p -100.57 -14.92 7.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.266 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.854 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.2 OUTLIER -91.36 -32.32 15.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.009 0.433 . . . . 0.0 110.462 179.893 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.781 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -59.3 -39.84 84.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.8 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.526 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.5 OUTLIER -65.88 -41.4 91.61 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.679 -179.59 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.711 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.8 mt -78.42 -32.29 16.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.897 ' HB3' HD13 ' B' ' 597' ' ' LEU . 1.1 mm? -49.89 -49.85 48.09 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 -178.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.686 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -66.49 -29.07 69.09 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.194 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.57 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.4 mmm180 -58.22 -21.69 48.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.992 0.425 . . . . 0.0 110.453 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.013 HD22 HD11 ' A' ' 463' ' ' LEU . 37.9 mt -60.74 -47.45 86.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.858 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.581 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.0 t-20 56.33 58.56 9.04 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.6 -179.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.581 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 95.5 Cg_endo -100.91 -158.95 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 124.027 3.151 . . . . 0.0 111.391 -179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.92 139.98 52.48 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.756 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.47 134.24 36.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.381 0.61 . . . . 0.0 111.407 -178.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -156.12 160.16 39.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.717 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.83 109.36 21.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.901 0.381 . . . . 0.0 111.591 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.516 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.67 110.91 22.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.92 179.072 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 59.58 43.21 16.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.697 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 72.93 12.38 5.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.337 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.43 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.7 tpmt? -116.12 132.8 56.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.634 0.254 . . . . 0.0 110.918 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.625 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -64.23 108.8 1.67 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.999 0.428 . . . . 0.0 110.715 179.802 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.516 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 15.9 m80 -122.64 124.87 44.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.034 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.669 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -105.65 123.81 48.54 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.565 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.673 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -178.81 169.18 1.65 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.162 0.506 . . . . 0.0 112.153 -178.52 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.705 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.5 pt? -118.95 169.23 10.06 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.452 179.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.402 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -139.78 106.31 5.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.994 0.426 . . . . 0.0 111.33 179.606 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.907 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . 0.42 ' O ' ' HB3' ' B' ' 590' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 p30 -58.24 -39.68 79.77 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.511 ' HD2' ' N ' ' B' ' 590' ' ' LEU . 1.0 OUTLIER -80.03 -21.0 44.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.528 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.961 ' CD1' HD21 ' A' ' 474' ' ' LEU . 17.3 tp -48.43 -29.82 4.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.024 0.44 . . . . 0.0 110.624 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . 0.484 HG23 ' OE2' ' B' ' 594' ' ' GLU . 72.8 mt -85.58 -29.55 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.623 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.586 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.35 -42.83 99.34 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.433 -179.705 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.849 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.58 -17.71 55.7 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.225 0.536 . . . . 0.0 109.845 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.82 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.4 OUTLIER -63.15 -33.8 76.25 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.671 179.686 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' B' ' 592' ' ' TYR . 7.1 pt-20 -78.6 -46.99 18.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.636 -178.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.682 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.5 pp -49.79 -26.68 2.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.101 0.477 . . . . 0.0 111.124 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.899 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.4 tp -72.32 -82.44 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.68 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.711 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.9 m . . . . . 0 N--CA 1.438 -1.036 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.774 -177.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.465 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.5 t . . . . . 0 CA--C 1.517 -0.323 0 CA-C-O 121.04 0.448 . . . . 0.0 110.917 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 32.2 p -131.83 168.07 18.47 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.65 0.738 . . . . 0.0 112.233 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.662 ' HA ' HG23 ' A' ' 496' ' ' ILE . 23.6 mt-10 -62.53 -52.96 61.39 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.315 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . 0.418 ' HA ' ' HG2' ' A' ' 460' ' ' ARG . 0.1 OUTLIER -60.83 -28.46 68.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.251 -179.46 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -67.68 -38.14 83.3 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.863 0.363 . . . . 0.0 111.322 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.841 HG13 HD11 ' A' ' 473' ' ' LEU . 21.0 t -72.38 -32.86 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.947 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.543 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -56.61 -49.61 74.44 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 178.636 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -59.01 -25.02 63.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.727 179.543 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.513 ' HH ' ' HZ ' ' A' ' 477' ' ' PHE . 14.7 m-30 -73.17 -46.54 50.16 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.108 0.48 . . . . 0.0 109.734 178.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.875 HD11 HD22 ' A' ' 500' ' ' LEU . 0.6 OUTLIER -65.72 -57.91 6.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.233 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.855 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.26 -27.76 2.67 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.087 0.47 . . . . 0.0 110.506 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . 0.578 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 31.0 ttt85 -87.98 -32.64 18.74 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.806 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.578 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER 169.29 153.15 0.15 Allowed Pre-proline 0 CA--C 1.53 0.21 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.746 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.675 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 40.3 Cg_endo -64.96 165.45 21.42 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.64 2.227 . . . . 0.0 113.595 -179.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.712 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -159.46 152.78 22.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.407 -179.125 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.692 HG22 ' O ' ' A' ' 511' ' ' MET . 12.3 p -96.82 155.87 16.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.502 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.0 OUTLIER -51.02 -45.86 61.4 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.888 -179.662 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.839 ' CG ' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -59.37 -53.73 54.87 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.033 178.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -61.43 -33.41 73.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.625 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.841 HD11 HG13 ' A' ' 459' ' ' VAL . 0.9 OUTLIER -71.01 -41.39 70.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.981 0.42 . . . . 0.0 111.5 -179.583 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.967 ' HB3' HD23 ' A' ' 493' ' ' LEU . 2.4 pp -84.39 -34.77 23.5 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.997 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.429 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -48.96 -31.81 8.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.716 0.293 . . . . 0.0 111.413 -179.385 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.495 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -81.14 -33.84 32.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.238 -179.871 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.513 ' HZ ' ' HH ' ' A' ' 462' ' ' TYR . 15.1 m-85 . . . . . 0 N--CA 1.455 -0.217 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 19.2 tp . . . . . 0 N--CA 1.448 -0.569 0 CA-C-O 120.973 0.416 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.86 143.87 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.789 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . 0.646 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.3 OUTLIER -59.88 -22.07 61.85 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.97 0.414 . . . . 0.0 110.002 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -82.69 -52.83 6.42 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.778 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -63.5 -38.79 92.47 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.978 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.418 HG23 ' HB3' ' A' ' 477' ' ' PHE . 93.0 m -51.45 -30.38 19.41 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.646 HG23 ' O ' ' A' ' 486' ' ' SER . 4.2 t -79.09 -43.15 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.032 179.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -57.12 -25.93 59.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.602 179.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.506 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.6 p -100.85 -13.83 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.307 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.967 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.5 OUTLIER -89.33 -37.07 15.17 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.086 0.469 . . . . 0.0 110.452 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.758 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -55.32 -40.22 70.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.386 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.506 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -63.99 -41.27 97.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.156 -179.171 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.662 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.4 mt -75.08 -45.84 41.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.899 ' HB3' HD13 ' B' ' 597' ' ' LEU . 3.2 mm? -36.3 -59.79 0.61 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.682 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.81 -30.16 68.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.774 0.321 . . . . 0.0 111.809 -178.85 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.408 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 1.2 tpt180 -60.29 -24.34 64.88 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.957 0.408 . . . . 0.0 110.75 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.875 HD22 HD11 ' A' ' 463' ' ' LEU . 52.2 mt -61.07 -47.22 87.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.69 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.574 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 50.2 t-20 58.45 59.12 6.1 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.962 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.574 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 71.5 Cg_endo -101.56 -160.1 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 124.045 3.164 . . . . 0.0 111.441 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.82 139.4 53.2 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 505' ' ' LYS . 7.9 ptt85 -79.69 131.54 35.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.482 0.658 . . . . 0.0 111.758 -178.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' A' ' 504' ' ' ARG . 0.1 OUTLIER -148.26 160.13 43.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.406 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.515 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 7.2 ptm -105.03 108.84 20.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.92 0.391 . . . . 0.0 111.295 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.557 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.59 110.88 22.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.011 179.274 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 59.7 41.65 18.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.793 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . 0.515 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 1.9 t0 73.95 13.85 4.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.209 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.448 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.11 132.01 56.78 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.926 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.692 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.15 108.7 1.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.095 0.474 . . . . 0.0 110.658 179.759 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.612 ' CE1' HG23 ' A' ' 469' ' ' THR . 19.7 m80 -122.8 127.12 48.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.107 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.627 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.54 123.91 48.81 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.646 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.675 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -177.52 169.39 2.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.254 0.55 . . . . 0.0 112.441 -178.66 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.712 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.4 pt? -117.4 169.18 9.71 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.213 -0.903 . . . . 0.0 108.942 178.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.429 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -138.0 106.45 5.82 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.479 179.787 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.855 ' HB2' HG22 ' A' ' 464' ' ' THR . 8.5 mm-40 . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.761 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . 0.429 ' OD1' ' N ' ' B' ' 589' ' ' HIS . 14.5 p-10 -50.7 -50.26 55.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.883 0.373 . . . . 0.0 111.874 -178.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . 0.429 ' N ' ' OD1' ' B' ' 588' ' ' ASP . 1.0 OUTLIER -80.53 -23.72 39.83 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.353 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 0.872 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.9 tp -55.15 -35.76 65.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.971 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 67.7 mt -85.88 -29.72 6.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.901 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.539 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.79 -42.62 81.36 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.474 -179.686 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.846 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -75.33 -22.16 57.84 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.2 0.524 . . . . 0.0 109.925 179.559 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.646 ' N ' HD13 ' B' ' 593' ' ' LEU . 72.4 tt0 -63.32 -30.87 71.93 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.888 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.425 ' HG3' ' N ' ' B' ' 596' ' ' ILE . 0.0 OUTLIER -76.89 -36.88 56.38 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.362 -179.038 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.96 HD11 ' HB1' ' A' ' 494' ' ' ALA . 4.0 pt -61.4 -26.54 39.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.114 0.483 . . . . 0.0 111.183 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.782 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.6 tp -72.83 -81.86 0.05 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.03 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.683 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.2 m . . . . . 0 N--CA 1.438 -1.05 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.724 -177.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.52 HG22 ' CE2' ' A' ' 477' ' ' PHE . 3.4 t . . . . . 0 CA--C 1.516 -0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.547 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.4 p -131.84 167.32 19.77 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.665 0.745 . . . . 0.0 112.449 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.708 ' HA ' HG23 ' A' ' 496' ' ' ILE . 19.2 mt-10 -63.04 -53.47 53.25 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 114.561 -1.199 . . . . 0.0 110.505 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.37 -28.28 65.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.88 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.438 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -72.63 -34.31 67.22 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.779 -179.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.705 ' CG1' HD21 ' A' ' 500' ' ' LEU . 18.3 t -75.97 -36.77 32.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.476 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.522 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -54.51 -45.46 73.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.932 0.396 . . . . 0.0 110.131 179.135 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.498 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -62.16 -29.31 70.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.891 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.681 ' HD2' HD21 ' A' ' 473' ' ' LEU . 10.7 m-30 -68.3 -44.13 76.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.072 0.463 . . . . 0.0 110.178 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 1.03 HD11 HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -67.24 -59.25 3.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.305 -179.657 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.674 HG22 ' CG ' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -49.58 -26.25 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.99 0.424 . . . . 0.0 110.572 179.894 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -90.07 -46.22 8.63 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.009 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.538 ' HE2' ' HG2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -171.78 131.02 0.73 Allowed Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.916 -179.584 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.618 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 10.7 Cg_endo -52.51 163.25 1.86 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.366 2.044 . . . . 0.0 112.405 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.633 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -157.39 159.12 37.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.245 0.545 . . . . 0.0 112.102 -178.609 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.714 HG22 ' O ' ' A' ' 511' ' ' MET . 5.1 p -102.54 155.59 18.17 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.161 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.526 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -51.77 -43.98 63.2 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.859 -179.485 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.844 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -60.54 -58.81 6.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.284 0.564 . . . . 0.0 109.735 178.855 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.16 -20.28 39.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.498 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.702 HD11 HG13 ' A' ' 459' ' ' VAL . 0.5 OUTLIER -87.57 -40.76 13.98 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.887 0.375 . . . . 0.0 111.702 -179.575 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.976 HD22 HG13 ' A' ' 490' ' ' VAL . 1.3 pp -84.03 -49.73 8.65 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.504 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.59 ' HD3' HD12 ' A' ' 474' ' ' LEU . 18.3 mmtp -48.72 -25.34 1.76 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.76 0.314 . . . . 0.0 111.475 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.534 ' HE2' HD23 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -81.55 -43.59 18.52 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.722 179.818 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.52 ' CE2' HG22 ' A' ' 454' ' ' VAL . 8.3 m-85 . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 121.092 0.473 . . . . 0.0 110.938 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.886 ' CD2' HG11 ' A' ' 492' ' ' VAL . 1.3 tp . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.997 0.427 . . . . 0.0 111.503 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.14 154.95 0.33 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.401 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 5.1 p -61.25 -26.3 67.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.515 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -90.73 -42.34 10.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.611 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.603 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.9 mt-30 -65.73 -40.99 92.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.092 179.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.464 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 89.5 m -50.28 -29.42 9.63 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 0.976 HG13 HD22 ' A' ' 474' ' ' LEU . 10.1 t -82.66 -40.85 17.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.004 179.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -58.34 -28.2 64.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.389 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 0.886 HG11 ' CD2' ' A' ' 484' ' ' LEU . 4.0 p -102.15 -8.89 9.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.384 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.931 HD23 ' HB3' ' A' ' 474' ' ' LEU . 2.3 tp -93.31 -40.59 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.043 0.449 . . . . 0.0 110.908 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.96 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -53.26 -45.23 68.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.279 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.459 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -58.84 -35.99 73.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.001 -179.447 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.708 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.6 mt -81.94 -32.25 11.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.782 ' HB3' HD13 ' B' ' 597' ' ' LEU . 3.5 mm? -50.98 -48.37 61.2 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.817 ' NZ ' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -62.02 -32.44 72.93 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -178.72 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.554 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 0.9 OUTLIER -57.74 -23.44 52.06 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.954 0.407 . . . . 0.0 110.526 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 1.03 HD22 HD11 ' A' ' 463' ' ' LEU . 50.8 mt -59.92 -47.36 86.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.698 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.592 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.0 t-20 55.91 57.96 9.79 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.44 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.592 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 87.9 Cg_endo -101.38 -160.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 123.879 3.052 . . . . 0.0 111.485 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.61 141.15 48.87 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.625 178.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -79.42 133.66 36.55 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.396 0.617 . . . . 0.0 111.368 -178.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -156.15 160.13 39.63 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.842 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.7 OUTLIER -105.16 110.27 22.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.902 0.382 . . . . 0.0 111.509 -179.813 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.551 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.65 110.92 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.781 178.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.5 44.27 15.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.74 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 71.72 13.04 6.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.318 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.442 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.7 tpmt? -116.17 132.03 56.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.644 -0.253 . . . . 0.0 110.886 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . 0.714 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.3 108.66 1.35 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.993 0.425 . . . . 0.0 110.589 179.721 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.569 ' CE1' HG23 ' A' ' 469' ' ' THR . 16.5 m80 -122.68 125.29 45.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.248 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.61 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -105.22 123.55 48.02 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.516 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.652 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.4 OUTLIER -177.98 169.38 1.97 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.151 0.501 . . . . 0.0 112.21 -178.896 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.723 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.3 pt? -116.57 169.16 9.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.286 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.45 106.43 6.65 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.026 0.441 . . . . 0.0 111.35 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.674 ' CG ' HG22 ' A' ' 464' ' ' THR . 4.7 pt-20 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.121 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 120.787 0.327 . . . . 0.0 111.532 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -51.02 -55.0 19.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.069 0.461 . . . . 0.0 111.611 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 589' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -79.57 -21.82 44.59 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.205 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 590' ' ' LEU . . . . . 1.0 HD11 ' HA ' ' A' ' 471' ' ' LYS . 37.9 tp -52.68 -29.56 27.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.937 0.399 . . . . 0.0 111.05 -179.936 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 97.3 mt -85.41 -29.5 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 CA-C-O 120.975 0.417 . . . . 0.0 110.786 -179.892 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 592' ' ' TYR . . . . . 0.6 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.91 -45.61 85.16 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.849 -179.507 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 593' ' ' LEU . . . . . 0.788 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -70.02 -18.22 63.3 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.972 0.415 . . . . 0.0 110.373 -179.704 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 594' ' ' GLU . . . . . 0.617 ' N ' HD13 ' B' ' 593' ' ' LEU . 62.5 tt0 -62.8 -30.79 71.74 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 120.853 0.358 . . . . 0.0 110.913 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 595' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' B' ' 592' ' ' TYR . 0.3 OUTLIER -80.19 -46.2 16.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.038 -179.343 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 596' ' ' ILE . . . . . 0.63 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -54.91 -26.54 17.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.944 0.402 . . . . 0.0 111.147 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 597' ' ' LEU . . . . . 0.942 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.8 tp -69.17 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.436 0.636 . . . . 0.0 111.833 179.996 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 598' ' ' VAL . . . . . 0.67 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.5 m . . . . . 0 N--CA 1.437 -1.096 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.593 -177.8 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.816 HG22 ' CD2' ' A' ' 477' ' ' PHE . 62.6 t . . . . . 0 CA--C 1.515 -0.369 0 CA-C-O 120.778 0.323 . . . . 0.0 110.575 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 455' ' ' THR . . . . . 0.44 ' O ' HG23 ' A' ' 459' ' ' VAL . 16.9 p -131.68 158.29 41.49 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.552 0.691 . . . . 0.0 112.483 -179.336 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 456' ' ' GLU . . . . . 0.745 ' HA ' HG23 ' A' ' 496' ' ' ILE . 17.1 mt-10 -50.19 -52.46 35.46 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.655 -1.157 . . . . 0.0 111.171 179.425 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.97 -30.75 71.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.376 -179.196 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 458' ' ' ALA . . . . . 0.454 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -70.52 -56.8 5.7 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.765 0.317 . . . . 0.0 111.461 -179.523 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.738 ' HB ' HD21 ' A' ' 500' ' ' LEU . 21.0 t -48.84 -26.47 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.711 0.291 . . . . 0.0 111.221 -179.574 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 460' ' ' ARG . . . . . 0.517 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.7 OUTLIER -61.73 -49.78 75.06 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.547 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 461' ' ' ARG . . . . . 0.483 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -57.94 -30.75 66.22 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.402 179.351 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 462' ' ' TYR . . . . . 0.495 ' CE2' ' CE2' ' A' ' 477' ' ' PHE . 8.5 m-30 -64.54 -42.58 95.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.189 0.518 . . . . 0.0 109.739 178.867 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 463' ' ' LEU . . . . . 0.83 HD11 HD22 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -71.84 -57.89 3.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.291 -179.9 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 464' ' ' THR . . . . . 0.586 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.07 -26.44 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.812 179.993 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -91.65 -50.68 5.63 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.116 179.785 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 466' ' ' LYS . . . . . 0.443 ' CE ' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -168.18 132.99 1.47 Allowed Pre-proline 0 N--CA 1.452 -0.352 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.054 -179.774 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 467' ' ' PRO . . . . . 0.511 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 37.1 Cg_exo -57.38 146.71 81.63 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.374 2.049 . . . . 0.0 113.116 -179.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 468' ' ' MET . . . . . 0.853 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -128.97 177.14 7.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.968 -179.571 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 469' ' ' THR . . . . . 0.725 HG22 ' CD2' ' A' ' 512' ' ' HIS . 1.4 p -115.06 157.16 23.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.919 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 470' ' ' THR . . . . . 0.537 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.6 OUTLIER -54.56 -39.56 67.86 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 120.159 -0.617 . . . . 0.0 110.664 -179.602 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 1.0 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -68.97 -60.39 2.4 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.253 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 472' ' ' ASP . . . . . 0.41 ' HB3' ' H ' ' A' ' 469' ' ' THR . 9.6 t70 -52.96 -24.94 10.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.192 179.893 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 473' ' ' LEU . . . . . 0.853 HD12 ' SD ' ' A' ' 468' ' ' MET . 0.7 OUTLIER -69.98 -40.1 75.56 Favored 'General case' 0 CA--C 1.523 -0.069 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.526 -179.438 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 1.039 HD22 HG22 ' A' ' 490' ' ' VAL . 0.9 OUTLIER -84.78 -25.69 28.04 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -179.499 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 475' ' ' LYS . . . . . 0.771 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 68.6 mmtt -57.68 -44.49 85.82 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -178.828 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 476' ' ' LYS . . . . . 0.775 ' HZ1' ' HA ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -74.39 -43.48 56.21 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.596 179.927 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 477' ' ' PHE . . . . . 0.816 ' CD2' HG22 ' A' ' 454' ' ' VAL . 5.1 m-85 . . . . . 0 CA--C 1.511 -0.521 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.062 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 1.041 HD23 HG11 ' A' ' 492' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.451 -0.396 0 CA-C-O 120.701 0.286 . . . . 0.0 111.098 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -39.35 153.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.969 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 486' ' ' SER . . . . . 0.419 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.7 OUTLIER -60.99 -26.15 67.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.261 179.256 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -88.73 -45.95 9.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.382 179.537 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 488' ' ' GLN . . . . . 0.764 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.5 mt-30 -63.48 -41.08 98.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.921 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 489' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 86.0 m -50.28 -30.51 12.03 Favored 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.637 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 490' ' ' VAL . . . . . 1.039 HG22 HD22 ' A' ' 474' ' ' LEU . 7.0 t -83.02 -40.43 16.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.001 179.034 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 491' ' ' ASN . . . . . 0.427 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 5.2 t30 -60.98 -30.87 70.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.938 178.928 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 492' ' ' VAL . . . . . 1.041 HG11 HD23 ' A' ' 484' ' ' LEU . 5.4 p -98.46 -6.85 9.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.887 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.761 HD23 HD23 ' A' ' 474' ' ' LEU . 19.8 tp -95.27 -42.01 8.76 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.994 0.426 . . . . 0.0 110.61 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . 0.545 ' HB2' ' HB2' ' B' ' 593' ' ' LEU . . . -54.45 -33.8 60.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.507 -179.921 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.473 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -67.84 -42.79 80.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.125 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 496' ' ' ILE . . . . . 0.745 HG23 ' HA ' ' A' ' 456' ' ' GLU . 12.9 mt -76.08 -46.89 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 112.368 0.506 . . . . 0.0 112.368 -179.06 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . 0.942 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -32.85 -64.33 0.19 Allowed 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -178.483 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 498' ' ' LYS . . . . . 0.63 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -61.47 -31.64 71.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.907 0.384 . . . . 0.0 111.575 -178.956 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 499' ' ' ARG . . . . . 0.427 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 2.4 tpt180 -57.59 -23.42 50.77 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.961 179.79 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.83 HD22 HD11 ' A' ' 463' ' ' LEU . 53.1 mt -62.37 -47.5 83.91 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.819 -179.366 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.591 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 50.9 t-20 56.5 58.31 8.83 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.787 -179.349 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 502' ' ' PRO . . . . . 0.591 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 65.2 Cg_endo -101.2 -158.97 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.338 0 C-N-CA 124.097 3.198 . . . . 0.0 111.536 -179.505 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.15 141.91 47.99 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.76 178.881 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.57 135.49 36.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.282 0.563 . . . . 0.0 111.44 -179.026 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -155.26 157.44 37.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.809 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 506' ' ' MET . . . . . 0.47 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 7.4 ptm -105.13 108.93 20.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.994 0.426 . . . . 0.0 111.598 -179.728 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 507' ' ' ILE . . . . . 0.43 HG12 ' HB2' ' A' ' 512' ' ' HIS . 1.2 mm -90.94 110.77 22.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.082 179.225 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.7 t30 59.03 40.35 22.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.764 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 509' ' ' ASP . . . . . 0.47 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 2.7 t70 76.62 12.12 2.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.359 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.447 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.6 tpmt? -116.17 130.65 56.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.765 0.317 . . . . 0.0 110.925 179.696 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 45.3 mmm -65.7 108.92 2.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.983 0.421 . . . . 0.0 111.023 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . 0.725 ' CD2' HG22 ' A' ' 469' ' ' THR . 15.1 m170 -122.15 135.35 54.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.289 179.512 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 513' ' ' PHE . . . . . 0.704 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -110.55 123.44 49.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.664 0.269 . . . . 0.0 111.08 -179.896 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 514' ' ' SER . . . . . 0.716 ' OG ' HD22 ' A' ' 463' ' ' LEU . 2.1 m -174.51 169.57 3.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.475 0.655 . . . . 0.0 112.563 -179.691 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 515' ' ' LEU . . . . . 0.779 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.1 pt? -114.35 169.04 9.33 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.551 178.599 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 516' ' ' LYS . . . . . 0.414 ' HD2' ' H ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -132.42 106.54 7.94 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.507 179.849 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.586 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.215 -0.897 . . . . 0.0 111.076 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.851 0.358 . . . . 5.8700000000000001 111.156 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -61.44 90.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.143 -0.481 . . . . 3.9199999999999999 110.914 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.578 HG23 ' HG2' ' B' ' 586' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -90.06 49.63 1.74 Allowed 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.007 0.432 . . . . 2.46 110.712 179.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.578 ' HG2' HG23 ' B' ' 584' ' ' TPO . 16.4 pt-20 -86.19 -36.79 19.27 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.966 -0.561 . . . . 2.2999999999999998 110.764 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.13 -22.64 31.0 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.681 -0.69 . . . . 2.3199999999999998 111.605 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -51.01 -55.06 19.28 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.993 0.425 . . . . 1.8899999999999999 111.626 -179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.47 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.1 p-80 -79.07 -21.85 46.17 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.749 -0.66 . . . . 0.54000000000000004 111.183 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.931 ' CD1' HD21 ' A' ' 474' ' ' LEU . 28.2 tp -56.44 -33.37 65.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.983 0.421 . . . . 0.40999999999999998 110.811 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . 0.422 HG23 ' OE2' ' B' ' 594' ' ' GLU . 70.1 mt -85.71 -29.71 6.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.267 -0.424 . . . . 0.68999999999999995 110.804 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.571 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.74 -44.32 86.34 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.142 -0.481 . . . . 1.54 111.446 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.789 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -75.22 -17.94 60.23 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 121.128 0.489 . . . . 0.32000000000000001 110.032 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.644 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.8 OUTLIER -63.17 -30.78 71.86 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.005 -0.543 . . . . 1.77 110.853 179.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.549 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 3.7 pt-20 -82.87 -43.92 16.02 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.608 0.596 . . . . 1.8500000000000001 112.608 -178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.684 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.6 pp -51.07 -26.61 4.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.059 0.456 . . . . 0.55000000000000004 111.231 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.872 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.2 tp -71.32 -82.7 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.527 0.68 . . . . 0.35999999999999999 111.733 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.698 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -141.85 30.4 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 CA-C-N 114.565 -1.198 . . . . 0.44 110.642 -177.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.549 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 28.7 mtp180 -140.41 40.79 1.9 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.545 -0.752 . . . . 2.04 111.205 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 31.3 m . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.247 -0.883 . . . . 1.8 111.111 179.949 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.886 0.374 . . . . 4.5700000000000003 111.159 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.777 ' O ' HG22 ' A' ' 482' ' ' THR . 8.3 p -61.99 144.1 14.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.205 -0.452 . . . . 1.8899999999999999 111.051 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -118.77 138.17 52.87 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.326 -0.397 . . . . 1.9199999999999999 110.988 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.592 HG22 ' CE2' ' A' ' 477' ' ' PHE . 14.2 t -71.04 110.57 4.08 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 CA-C-N 116.163 -0.471 . . . . 0.58999999999999997 110.78 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.479 ' O ' HG23 ' A' ' 459' ' ' VAL . 28.7 p -131.71 165.34 23.95 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.613 0.72 . . . . 0.38 112.424 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.682 ' HA ' HG23 ' A' ' 496' ' ' ILE . 18.2 mt-10 -60.16 -53.23 60.22 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 114.557 -1.201 . . . . 1.25 110.566 179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -60.32 -28.89 68.49 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.261 -0.881 . . . . 1.29 112.162 -179.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.492 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -71.3 -37.68 71.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.453 -0.34 . . . . 0.38 111.734 -179.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.776 HG13 HD11 ' A' ' 473' ' ' LEU . 21.9 t -72.52 -32.32 41.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 120.842 -0.343 . . . . 0.28000000000000003 111.541 -179.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.522 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -58.12 -39.56 79.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.391 -0.368 . . . . 2.2599999999999998 110.429 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -67.12 -29.59 69.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 2.54 110.478 179.816 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.462 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 5.0 m-30 -69.27 -39.74 78.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.213 -0.449 . . . . 1.27 110.242 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.946 HD11 HD22 ' A' ' 500' ' ' LEU . 2.0 mt -69.89 -63.67 1.03 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.706 -0.679 . . . . 0.39000000000000001 111.733 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.794 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.62 -26.31 1.45 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.072 -0.513 . . . . 0.54000000000000004 110.929 -179.659 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 4.4 ttt180 -88.13 -46.81 8.97 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.896 -0.593 . . . . 3.27 111.221 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.412 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.8 OUTLIER -170.06 133.94 1.13 Allowed Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.573 -0.285 . . . . 3.9700000000000002 110.891 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.646 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 13.9 Cg_endo -54.83 156.22 15.81 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.444 2.096 . . . . 0.56999999999999995 112.612 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.731 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.47 163.02 39.46 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.317 0.58 . . . . 0.92000000000000004 111.899 -179.111 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.684 HG22 ' O ' ' A' ' 511' ' ' MET . 4.3 p -106.11 158.92 16.47 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 107.819 -1.178 . . . . 0.60999999999999999 107.819 177.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.506 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.4 OUTLIER -53.49 -46.62 70.08 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.291 -0.564 . . . . 0.62 110.95 -179.658 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.824 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -59.53 -52.02 67.37 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.885 -0.598 . . . . 1.3200000000000001 110.267 179.171 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -63.61 -32.05 73.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.775 -0.648 . . . . 1.1399999999999999 111.563 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.776 HD11 HG13 ' A' ' 459' ' ' VAL . 0.9 OUTLIER -71.55 -39.39 70.71 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.998 0.428 . . . . 0.95999999999999996 111.354 -179.657 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 1.002 ' HB3' HD23 ' A' ' 493' ' ' LEU . 1.4 pp -83.59 -43.43 15.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.953 -0.567 . . . . 0.55000000000000004 111.548 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.29 -33.98 44.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.5 -0.318 . . . . 2.5299999999999998 111.314 -179.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.458 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -69.52 -39.67 77.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.384 -0.371 . . . . 2.02 111.249 -179.693 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.592 ' CE2' HG22 ' A' ' 454' ' ' VAL . 15.2 m-85 -66.13 -66.73 0.51 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.493 0.663 . . . . 1.25 110.102 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 51.1 174.7 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.733 -1.121 . . . . 2.54 111.599 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 8.1 m -75.11 0.37 16.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.955 -0.566 . . . . 3.0800000000000001 111.488 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -45.03 -39.49 5.73 Favored 'General case' 0 CA--C 1.529 0.146 0 N-CA-C 111.942 0.349 . . . . 5.1399999999999997 111.942 -179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt -139.24 -47.09 0.47 Allowed 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.871 0.322 . . . . 3.21 111.871 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.777 HG22 ' O ' ' A' ' 452' ' ' VAL . 12.4 p -53.54 -16.11 1.39 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.61 -0.268 . . . . 0.89000000000000001 111.263 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 62.14 19.54 59.44 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.377 -0.916 . . . . 0.76000000000000001 111.224 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.839 ' CD2' HG11 ' A' ' 492' ' ' VAL . 3.4 mp -104.39 123.71 47.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 120.94 0.4 . . . . 0.97999999999999998 111.226 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.55 157.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.748 -0.66 . . . . 0.66000000000000003 111.688 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.4 -24.35 67.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 1.5700000000000001 110.154 179.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.421 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 8.7 mt-10 -90.78 -45.17 8.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.779 -0.646 . . . . 1.53 110.544 179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.622 ' O ' HG12 ' A' ' 492' ' ' VAL . 4.2 mt-30 -63.38 -42.78 98.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.58 -0.736 . . . . 1.1399999999999999 110.052 179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.432 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 93.4 m -50.19 -28.59 7.76 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 121.086 0.469 . . . . 0.40999999999999998 109.747 178.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.608 HG13 HD22 ' A' ' 474' ' ' LEU . 5.1 t -84.73 -41.27 15.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.562 -0.745 . . . . 0.34999999999999998 109.982 179.013 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . 0.409 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 3.3 t30 -57.89 -26.13 61.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.265 -0.88 . . . . 0.40999999999999998 110.374 179.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.839 HG11 ' CD2' ' A' ' 484' ' ' LEU . 3.6 p -101.96 -14.41 8.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.871 -0.604 . . . . 0.31 111.103 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 1.002 HD23 ' HB3' ' A' ' 474' ' ' LEU . 1.4 tp -88.83 -35.98 16.28 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.059 0.456 . . . . 0.98999999999999999 110.585 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.626 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -56.08 -41.97 75.99 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.978 -0.556 . . . . 0.28999999999999998 111.305 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.523 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.21 -38.59 91.6 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.864 -0.607 . . . . 0.82999999999999996 112.259 -179.212 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.682 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.7 mt -79.84 -30.45 13.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 112.922 0.712 . . . . 0.31 112.922 -178.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.872 ' HB3' HD13 ' B' ' 597' ' ' LEU . 1.1 mm? -49.93 -54.12 21.81 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.048 0.388 . . . . 0.56999999999999995 112.048 -178.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.684 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.98 -29.97 68.8 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.504 0.557 . . . . 0.79000000000000004 112.504 -178.336 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.578 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.7 mmm180 -60.48 -22.81 63.93 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.998 0.428 . . . . 2.4100000000000001 110.475 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.946 HD22 HD11 ' A' ' 463' ' ' LEU . 77.0 mt -61.15 -47.56 85.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.779 -0.646 . . . . 0.34000000000000002 111.841 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.616 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.5 t-20 55.89 56.3 9.78 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 116.028 -0.533 . . . . 0.60999999999999999 110.051 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.616 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 49.2 Cg_endo -99.55 -160.35 0.04 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 123.965 3.11 . . . . 0.26000000000000001 111.518 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.81 140.83 49.31 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 116.042 -0.526 . . . . 1.1699999999999999 109.769 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.57 134.46 36.47 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.384 0.611 . . . . 2.5 111.463 -179.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 19.8 mtmt -156.11 160.14 39.68 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.105 -0.952 . . . . 0.78000000000000003 109.727 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.415 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.7 OUTLIER -105.04 110.09 22.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.875 0.369 . . . . 0.62 111.643 -179.797 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.535 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.74 110.9 22.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.38 109.872 179.04 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 32.6 t30 59.12 44.15 16.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.323 -0.398 . . . . 1.3999999999999999 110.829 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 72.02 13.08 5.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.121 -0.49 . . . . 1.6599999999999999 111.414 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.429 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.11 132.95 56.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.616 -0.266 . . . . 1.25 110.885 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.684 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.98 108.67 1.56 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.028 0.442 . . . . 1.1299999999999999 110.747 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.535 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 16.1 m80 -122.75 124.92 44.47 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.724 -0.671 . . . . 1.55 111.026 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.575 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.1 OUTLIER -106.08 123.54 48.16 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.765 -0.457 . . . . 1.27 109.765 178.676 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.67 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.2 OUTLIER 179.6 169.33 1.12 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.163 0.506 . . . . 0.54000000000000004 111.936 -178.907 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.582 ' CD2' ' HB2' ' A' ' 463' ' ' LEU . 0.4 OUTLIER -110.83 169.52 8.7 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.541 -0.754 . . . . 1.52 110.249 179.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.31 105.39 4.58 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.172 0.51 . . . . 1.1799999999999999 110.867 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.794 ' HG2' HG22 ' A' ' 464' ' ' THR . 4.5 pt-20 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.244 -0.884 . . . . 3.3300000000000001 110.993 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.759 0.314 . . . . 0.0 111.149 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -64.97 79.69 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.898 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.554 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . 0.411 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 3.5 t70 -89.98 49.57 1.73 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.981 0.42 . . . . 0.0 110.789 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.461 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 1.0 OUTLIER -86.11 -38.31 17.9 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.839 179.52 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . 0.636 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.4 OUTLIER -84.13 -22.75 30.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.696 -0.683 . . . . 0.0 111.578 -179.419 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -53.3 -55.02 28.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.021 0.438 . . . . 0.0 111.546 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.461 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.0 OUTLIER -79.83 -21.77 43.81 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.254 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.903 HD11 ' HA ' ' A' ' 471' ' ' LYS . 30.0 tp -50.86 -35.43 32.57 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.184 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 75.3 mt -85.89 -29.42 6.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.898 0.38 . . . . 0.0 110.908 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.535 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.21 -45.23 95.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.294 -179.793 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.794 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.6 -18.53 54.42 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 120.958 0.409 . . . . 0.0 110.35 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.65 ' N ' HD13 ' B' ' 593' ' ' LEU . 69.1 tt0 -63.19 -30.97 72.01 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.962 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.509 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 6.8 pt-20 -82.43 -42.59 18.36 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 1.002 HD12 ' HE3' ' A' ' 498' ' ' LYS . 1.0 OUTLIER -52.39 -26.79 9.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.224 0.535 . . . . 0.0 111.504 -179.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' A' ' 497' ' ' LEU . 14.3 tp -74.62 -81.07 0.07 Allowed 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.426 -0.807 . . . . 0.0 112.492 -179.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.678 HG13 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -140.37 29.7 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.105 0 CA-C-N 114.459 -1.246 . . . . 0.0 110.617 -177.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.509 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 11.9 mtp-105 -142.22 38.94 1.58 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.274 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 23.7 m . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.204 -0.903 . . . . 0.0 111.131 -179.993 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.794 0.33 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.562 ' O ' HG22 ' A' ' 482' ' ' THR . 12.1 t -61.1 161.04 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.063 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.485 ' N ' HG12 ' A' ' 452' ' ' VAL . 0.0 OUTLIER -120.9 134.06 55.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.794 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.532 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.7 t -78.99 112.01 16.53 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.025 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 31.4 p -131.91 173.32 11.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.663 0.744 . . . . 0.0 112.605 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.761 ' HA ' HG23 ' A' ' 496' ' ' ILE . 13.3 mt-10 -69.03 -52.53 27.67 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.574 179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.64 -27.82 68.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.175 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . . . . . . . . . . . -65.16 -58.07 6.95 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.974 0.416 . . . . 0.0 111.174 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.775 HG11 HD11 ' A' ' 500' ' ' LEU . 21.7 t -52.29 -25.57 7.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.621 -179.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.2 mmm-85 -62.95 -41.8 99.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.927 0.394 . . . . 0.0 110.468 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.76 -23.92 67.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.597 179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.521 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 14.7 m-30 -76.04 -44.05 41.0 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.775 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.68 HD11 HD22 ' A' ' 500' ' ' LEU . 1.1 mt -65.98 -59.67 3.59 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.748 0.309 . . . . 0.0 111.328 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.513 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -50.0 -26.21 4.07 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.039 0.447 . . . . 0.0 110.358 179.647 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -88.8 -42.46 11.89 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.724 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.519 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -172.54 161.62 4.07 Favored Pre-proline 0 CA--C 1.531 0.231 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.326 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.643 ' HB2' ' CD2' ' A' ' 512' ' ' HIS . 69.0 Cg_endo -73.3 173.03 14.43 Favored 'Trans proline' 0 N--CA 1.464 -0.252 0 C-N-CA 121.857 1.705 . . . . 0.0 112.91 -179.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.962 ' HG3' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -166.81 159.77 13.98 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-O 121.703 0.763 . . . . 0.0 112.613 -179.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.55 ' HB ' ' HZ2' ' A' ' 471' ' ' LYS . 9.2 p -113.51 155.8 24.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.559 -1.201 . . . . 0.0 108.333 177.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.756 ' HA ' HD12 ' A' ' 473' ' ' LEU . 0.6 OUTLIER -50.74 -43.75 58.23 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.53 -178.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.903 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -60.86 -56.92 15.49 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.153 0.502 . . . . 0.0 109.973 179.016 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -56.78 -19.87 19.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.963 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 1.016 ' CD1' HD11 ' A' ' 497' ' ' LEU . 5.9 mt -81.69 -37.89 26.68 Favored 'General case' 0 N--CA 1.462 0.143 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -179.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.882 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.4 OUTLIER -84.05 -42.53 16.04 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -178.719 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.611 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 26.3 mmtm -47.21 -27.41 1.48 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.686 0.279 . . . . 0.0 111.612 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.478 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -87.33 -40.27 14.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.996 179.677 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.532 ' CD2' HG22 ' A' ' 454' ' ' VAL . 15.7 m-85 -74.94 -0.46 18.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -46.31 173.51 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.027 0.441 . . . . 0.0 111.775 -179.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 484' ' ' LEU . 36.9 p -55.01 -17.68 4.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.56 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 2.6 tmtm? -39.56 -32.11 0.12 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.911 0.337 . . . . 0.0 111.911 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 8.2 mmmt -139.66 -63.77 0.5 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.631 0.253 . . . . 0.0 111.61 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.562 HG22 ' O ' ' A' ' 452' ' ' VAL . 11.9 p -58.71 -8.85 1.43 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.353 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 61.31 21.19 59.48 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.659 -178.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.818 HD21 HG11 ' A' ' 492' ' ' VAL . 9.1 tp -94.9 125.22 39.41 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.072 -0.564 . . . . 0.0 111.395 -179.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.94 144.04 3.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.4 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 39.4 t -59.27 -20.03 50.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.786 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.405 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 9.7 mt-10 -94.61 -43.53 8.26 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.087 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.616 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.4 mt-30 -68.88 -40.75 79.05 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.184 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.513 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 41.4 m -50.87 -28.79 10.3 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.651 HG12 ' HG ' ' B' ' 593' ' ' LEU . 3.5 t -82.01 -41.96 18.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.395 179.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -59.52 -28.16 66.81 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.302 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.818 HG11 HD21 ' A' ' 484' ' ' LEU . 6.3 p -102.02 -6.95 9.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.019 179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.612 HD21 ' CB ' ' A' ' 473' ' ' LEU . 10.2 tp -94.27 -44.77 7.8 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.801 0.334 . . . . 0.0 110.936 -179.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.94 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -51.92 -38.1 55.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.207 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.478 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -61.32 -40.08 92.86 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.173 -0.467 . . . . 0.0 112.185 -179.368 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.761 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.5 mt -74.95 -50.14 26.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -179.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 1.016 HD11 ' CD1' ' A' ' 473' ' ' LEU . 0.5 OUTLIER -32.2 -44.15 0.09 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -178.194 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 1.002 ' HE3' HD12 ' B' ' 596' ' ' ILE . 0.1 OUTLIER -70.1 -38.16 75.59 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 113.07 0.767 . . . . 0.0 113.07 -177.8 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.576 ' HG3' ' HG2' ' A' ' 456' ' ' GLU . 1.4 mmm180 -58.79 -20.81 53.31 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.963 0.411 . . . . 0.0 110.578 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.775 HD11 HG11 ' A' ' 459' ' ' VAL . 67.4 mt -57.85 -47.58 82.29 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.86 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.55 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.7 t-20 60.58 58.85 3.92 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.143 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.55 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.0 Cg_endo -101.14 -162.71 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.118 0 C-N-CA 124.168 3.245 . . . . 0.0 111.943 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.1 138.35 54.23 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.418 178.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.63 131.48 35.99 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.56 0.695 . . . . 0.0 112.104 -178.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.586 ' HE3' ' CE1' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -156.6 160.43 39.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.307 179.43 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.19 108.88 20.66 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.492 0.552 . . . . 0.0 112.492 -179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.629 HG12 ' ND1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -89.62 110.81 22.18 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.52 178.185 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 64.28 42.53 5.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.154 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.3 t0 67.21 20.07 10.22 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.354 179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.405 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.13 130.02 56.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.653 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 7.1 tpt -62.75 106.94 0.87 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.151 -0.62 . . . . 0.0 109.732 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.643 ' CD2' ' HB2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -124.55 156.15 37.84 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.883 -179.251 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.474 ' CZ ' HD23 ' B' ' 597' ' ' LEU . 0.2 OUTLIER -133.21 122.42 23.94 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.674 177.733 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.614 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.1 OUTLIER -177.76 169.33 2.07 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.064 0.459 . . . . 0.0 111.513 -179.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.796 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -123.67 168.0 13.24 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.935 178.59 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.444 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -137.87 106.28 5.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.976 179.558 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.513 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.159 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.82 0.343 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -60.38 92.53 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.842 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.627 ' O1P' HG21 ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . 0.409 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 3.6 t70 -90.12 49.62 1.73 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.923 0.392 . . . . 0.0 110.614 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.469 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 3.0 pp20? -86.21 -40.62 15.4 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.751 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . 0.631 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.4 OUTLIER -84.24 -22.83 30.67 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.579 -179.391 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -51.7 -55.19 20.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.094 0.473 . . . . 0.0 111.769 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.638 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.1 p-80 -78.69 -21.94 47.46 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.239 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.904 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.3 tp -58.83 -29.49 66.95 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.08 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 86.2 mt -85.96 -32.54 6.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.638 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.2 OUTLIER -71.71 -38.37 70.54 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.388 -0.525 . . . . 0.0 112.158 -178.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.814 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -70.58 -17.97 62.9 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.112 179.964 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.52 ' N ' HD13 ' B' ' 593' ' ' LEU . 4.2 pt-20 -62.25 -30.68 71.29 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.739 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.533 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 1.5 pt-20 -82.82 -42.96 17.22 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -179.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.667 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.0 pp -52.48 -26.48 9.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.228 0.537 . . . . 0.0 110.816 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.879 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.4 tp -72.85 -82.27 0.05 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.249 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.68 HG22 ' HG ' ' B' ' 597' ' ' LEU . 31.2 m -141.31 29.72 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.052 0 CA-C-N 114.565 -1.198 . . . . 0.0 110.757 -177.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.533 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 26.2 mtp180 -140.82 39.83 1.83 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.303 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . 0.413 ' O ' HG22 ' B' ' 600' ' ' VAL . 9.6 p . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.099 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 2.5 p30 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.827 0.346 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.792 ' C ' HG22 ' A' ' 482' ' ' THR . 41.0 t -61.06 159.74 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.031 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.506 ' N ' HG12 ' A' ' 452' ' ' VAL . 1.1 mt-30 -148.21 133.65 18.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.89 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.578 HG22 ' CD2' ' A' ' 477' ' ' PHE . 26.6 t -59.37 109.72 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.285 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.793 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.425 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.2 p -131.65 167.69 19.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.716 0.77 . . . . 0.0 112.479 -179.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.738 ' HA ' HG23 ' A' ' 496' ' ' ILE . 22.1 mt-10 -62.94 -53.08 59.62 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.645 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.98 -27.42 68.82 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.942 -1.026 . . . . 0.0 112.533 -178.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.446 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -66.66 -58.34 5.34 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.911 0.386 . . . . 0.0 111.238 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.954 HG13 HD11 ' A' ' 473' ' ' LEU . 16.9 t -49.76 -31.68 6.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.187 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.575 ' HD3' HD23 ' A' ' 500' ' ' LEU . 1.0 OUTLIER -55.54 -47.31 76.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.396 178.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.46 ' HG2' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -60.73 -26.79 67.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.939 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.691 ' HD2' HD21 ' A' ' 473' ' ' LEU . 4.3 m-30 -73.35 -45.35 55.61 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.048 0.451 . . . . 0.0 110.314 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.04 HD11 HD13 ' A' ' 500' ' ' LEU . 2.5 mt -67.2 -58.46 4.81 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.842 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.564 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.2 OUTLIER -52.11 -23.84 6.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.908 0.385 . . . . 0.0 110.924 -179.788 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 15.8 ttt-85 -93.44 -44.24 8.35 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.308 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.461 ' HE2' ' HG2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -168.15 134.02 1.59 Allowed Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.005 -179.761 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.495 ' HA ' ' HB2' ' A' ' 514' ' ' SER . 30.6 Cg_endo -60.94 142.11 96.57 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.244 1.963 . . . . 0.0 112.607 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.592 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -128.07 178.74 6.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.329 -179.422 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.695 HG23 ' ND1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -119.34 154.26 33.85 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 177.369 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.529 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -51.24 -44.66 61.75 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.04 -0.664 . . . . 0.0 110.839 -179.34 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.831 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -65.6 -54.8 22.72 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.484 178.514 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . 0.426 ' HB3' ' H ' ' A' ' 469' ' ' THR . 24.9 t0 -58.65 -21.16 53.33 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.704 179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.954 HD11 HG13 ' A' ' 459' ' ' VAL . 0.4 OUTLIER -80.14 -40.65 26.95 Favored 'General case' 0 CA--C 1.522 -0.124 0 CA-C-O 121.106 0.479 . . . . 0.0 111.628 -179.606 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.904 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.9 OUTLIER -83.8 -48.53 9.98 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.58 -178.968 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.597 ' HD3' HD12 ' A' ' 474' ' ' LEU . 29.9 mmtp -48.8 -26.72 2.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.693 0.282 . . . . 0.0 111.667 -179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.442 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -78.84 -36.16 42.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.1 179.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.59 ' HB2' HG21 ' A' ' 489' ' ' THR . 11.5 m-85 -67.24 -52.86 35.78 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 121.371 0.605 . . . . 0.0 111.009 179.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . 0.404 ' HB3' ' HA ' ' A' ' 486' ' ' SER . 0.0 OUTLIER -57.03 130.23 45.19 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.084 -0.962 . . . . 0.0 111.19 -179.362 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 74.78 3.2 4.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.82 179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 11.6 tptp -83.32 -54.74 4.77 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.818 0.342 . . . . 0.0 110.892 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 9.2 tptt -177.78 -34.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.097 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.792 HG22 ' C ' ' A' ' 452' ' ' VAL . 11.9 p -55.14 -19.47 7.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.974 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 68.7 18.62 72.34 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.936 -179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.444 ' CD2' HG11 ' A' ' 492' ' ' VAL . 4.7 mp -94.97 126.42 40.3 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.018 0.437 . . . . 0.0 111.352 -179.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.42 154.7 1.7 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.581 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . 0.504 ' O ' HG23 ' A' ' 490' ' ' VAL . 53.2 p -62.31 -23.54 66.8 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.019 178.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.459 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 14.8 mt-10 -87.44 -51.97 5.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.558 179.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -62.02 -41.79 98.46 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.353 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.59 HG21 ' HB2' ' A' ' 477' ' ' PHE . 62.0 m -49.13 -39.69 29.53 Favored 'General case' 0 CA--C 1.521 -0.15 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.744 HG13 HD22 ' A' ' 474' ' ' LEU . 2.3 t -66.42 -49.96 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.385 179.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.01 -28.36 9.85 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.762 179.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.546 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.1 p -102.04 -13.8 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.011 179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 1.022 HD22 ' CD2' ' A' ' 497' ' ' LEU . 0.4 OUTLIER -89.49 -41.19 12.19 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 120.751 0.31 . . . . 0.0 110.841 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.549 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -50.52 -41.2 53.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.08 0.467 . . . . 0.0 110.774 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.546 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -65.85 -40.06 91.37 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.375 -179.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.738 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.4 mt -75.84 -39.17 37.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.914 -179.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 1.022 ' CD2' HD22 ' A' ' 493' ' ' LEU . 2.4 mm? -42.95 -60.34 1.66 Allowed 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -178.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.667 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.79 -28.76 67.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.862 0.363 . . . . 0.0 111.522 -179.058 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -27.07 66.08 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.172 0.51 . . . . 0.0 110.609 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.04 HD13 HD11 ' A' ' 463' ' ' LEU . 45.0 mt -60.58 -47.41 86.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.744 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.576 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.2 t-20 57.22 58.25 7.8 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.743 -179.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.576 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 78.7 Cg_endo -101.31 -159.63 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.428 0 C-N-CA 124.039 3.159 . . . . 0.0 111.504 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.0 141.8 48.07 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.927 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . 0.454 ' HB2' ' HE1' ' A' ' 511' ' ' MET . 4.3 ppt_? -79.58 135.32 36.57 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.293 0.568 . . . . 0.0 111.315 -179.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.4 mtmt -155.57 134.65 12.17 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.698 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.512 ' HB2' ' HE2' ' A' ' 506' ' ' MET . 12.4 ptm -82.83 110.43 17.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.013 0.435 . . . . 0.0 111.636 -179.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.484 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.68 111.0 22.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.748 178.973 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 58.9 t30 60.4 38.72 19.23 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.913 0.387 . . . . 0.0 110.464 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 3.5 t0 78.58 11.79 1.62 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.408 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 507' ' ' ILE . 0.0 OUTLIER -116.26 125.48 52.26 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.694 0.283 . . . . 0.0 111.271 179.83 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.552 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -57.47 109.07 0.62 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.987 0.422 . . . . 0.0 110.954 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.695 ' ND1' HG23 ' A' ' 469' ' ' THR . 9.2 m80 -120.43 138.72 53.63 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.722 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.711 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -107.49 124.17 49.49 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.279 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.495 ' HB2' ' HA ' ' A' ' 467' ' ' PRO . 0.6 OUTLIER -170.34 169.36 7.63 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -178.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.608 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.1 pt? -128.9 169.02 15.13 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.893 -1.048 . . . . 0.0 108.997 178.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.409 ' H ' ' HD2' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -129.67 106.54 8.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.017 0.437 . . . . 0.0 111.289 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.564 ' HG2' HG22 ' A' ' 464' ' ' THR . 4.8 pt-20 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.251 -0.88 . . . . 0.0 111.02 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.826 0.346 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.28 87.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.847 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.559 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -90.12 49.8 1.76 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.956 0.408 . . . . 0.0 110.699 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.579 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.6 pt-20 -86.0 -48.66 8.47 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.638 179.381 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . 0.487 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.4 OUTLIER -53.5 -22.34 7.91 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.565 -179.875 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -50.86 -44.65 59.64 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.921 0.391 . . . . 0.0 111.331 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.579 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.9 p-80 -80.31 -21.93 42.05 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.577 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.922 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.6 tp -55.86 -31.74 63.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.998 0.428 . . . . 0.0 110.861 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.1 mt -85.91 -29.53 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.504 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.998 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.544 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.77 -39.81 91.39 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.634 -179.436 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.858 HD23 ' CB ' ' A' ' 494' ' ' ALA . 0.0 OUTLIER -78.63 -18.58 54.28 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.084 0.468 . . . . 0.0 110.037 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.826 ' N ' HD13 ' B' ' 593' ' ' LEU . 52.3 tt0 -63.53 -34.19 77.25 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.445 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.466 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 6.5 pt-20 -76.68 -44.7 32.6 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -178.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.987 HD12 ' HE2' ' A' ' 498' ' ' LYS . 2.9 pt -50.66 -26.87 4.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 121.158 0.504 . . . . 0.0 111.789 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.786 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.9 tp -75.36 -80.67 0.08 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.43 -179.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.697 HG13 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -141.89 30.9 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.116 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.602 -177.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.466 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 25.4 mtp85 -142.31 41.84 1.63 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.437 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 8.8 m . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.081 179.958 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.854 0.359 . . . . 0.0 111.299 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.753 HG13 HG22 ' A' ' 482' ' ' THR . 8.1 p -171.69 159.77 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.061 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.492 ' N ' HG22 ' A' ' 452' ' ' VAL . 0.2 OUTLIER -149.98 135.61 18.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.843 0.354 . . . . 0.0 110.953 -179.734 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.665 HG22 ' CD2' ' A' ' 477' ' ' PHE . 12.5 t -68.59 112.74 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.332 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.912 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.551 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.8 p -131.78 165.97 22.59 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.607 0.717 . . . . 0.0 112.485 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.756 ' HA ' HG23 ' A' ' 496' ' ' ILE . 16.9 mt-10 -61.24 -53.74 53.01 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.54 179.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.49 -28.07 65.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.188 -0.915 . . . . 0.0 112.206 -179.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.425 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -74.1 -38.26 63.91 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.701 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.807 ' HB ' HD21 ' A' ' 500' ' ' LEU . 15.7 t -70.59 -37.92 71.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.206 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 2.0 mmm-85 -52.54 -54.82 27.61 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.481 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -56.45 -27.46 56.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.85 179.497 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.487 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 17.5 m-30 -73.52 -46.96 44.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.13 179.091 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.015 HD11 HD13 ' A' ' 500' ' ' LEU . 2.1 mt -65.79 -57.44 7.97 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.407 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.714 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.2 OUTLIER -48.27 -27.54 2.55 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.11 0.481 . . . . 0.0 110.421 179.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.493 ' O ' ' HG2' ' A' ' 466' ' ' LYS . 10.8 ttt85 -88.58 -54.08 4.34 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.648 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.538 ' HD3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -158.81 152.13 18.84 Favored Pre-proline 0 CA--C 1.533 0.305 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.974 179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.567 ' HB2' ' HB3' ' A' ' 512' ' ' HIS . 80.9 Cg_endo -72.97 175.86 9.85 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.619 2.213 . . . . 0.0 112.94 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.697 ' HG3' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -168.46 166.25 12.28 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.204 0.526 . . . . 0.0 112.044 -178.719 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.614 HG22 ' CD2' ' A' ' 512' ' ' HIS . 4.1 p -105.36 154.97 19.57 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 177.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.76 ' HA ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -55.64 -33.71 64.29 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.463 -0.495 . . . . 0.0 111.141 -179.564 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.878 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.1 OUTLIER -69.38 -52.03 31.02 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.309 0.576 . . . . 0.0 109.463 178.9 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -58.82 -31.13 68.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.378 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.939 ' CD1' HD11 ' A' ' 497' ' ' LEU . 3.2 mt -64.7 -48.58 74.15 Favored 'General case' 0 CA--C 1.522 -0.099 0 CA-C-O 120.939 0.399 . . . . 0.0 111.271 -179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.922 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.8 OUTLIER -79.67 -32.09 41.45 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.956 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.401 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -58.73 -26.83 64.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.175 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -86.28 -43.05 13.24 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.587 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.665 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.8 m-85 -67.4 -68.76 0.36 Allowed 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.488 0.661 . . . . 0.0 110.192 179.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.27 174.44 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.716 -1.129 . . . . 0.0 111.594 179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . 0.432 ' HB ' ' O ' ' A' ' 484' ' ' LEU . 12.7 t -73.04 -6.27 44.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.349 179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -45.48 -29.21 1.07 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.782 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . 0.522 ' CB ' HG12 ' A' ' 452' ' ' VAL . 0.3 OUTLIER -136.87 -57.77 0.72 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 121.089 -0.244 . . . . 0.0 111.509 -179.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.753 HG22 HG13 ' A' ' 452' ' ' VAL . 19.1 p -53.66 -14.46 0.89 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.239 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 65.48 18.36 65.51 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.373 -0.918 . . . . 0.0 111.066 -179.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.565 ' CD2' HG11 ' A' ' 492' ' ' VAL . 3.3 mp -106.83 121.43 44.38 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 120.914 0.388 . . . . 0.0 111.277 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -41.37 152.72 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.913 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . 0.544 ' O ' HG23 ' A' ' 490' ' ' VAL . 2.2 p -61.56 -24.72 66.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.07 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -84.36 -53.51 5.41 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.531 179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -59.93 -43.46 94.92 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.034 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 54.9 m -47.78 -32.26 5.79 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-O 121.194 0.521 . . . . 0.0 109.704 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.868 HG22 HD22 ' A' ' 474' ' ' LEU . 3.9 t -75.62 -45.47 38.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.04 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -56.51 -27.36 57.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.118 179.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.565 HG11 ' CD2' ' A' ' 484' ' ' LEU . 8.3 p -102.11 -12.77 8.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.087 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.621 HD23 ' HB3' ' A' ' 474' ' ' LEU . 10.2 tp -89.39 -41.3 12.19 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 120.786 0.327 . . . . 0.0 110.913 -179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.923 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -53.99 -41.04 67.48 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.013 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.7 OUTLIER -57.17 -41.37 79.13 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.432 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.756 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.8 mt -79.84 -31.2 13.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 -177.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.939 HD11 ' CD1' ' A' ' 473' ' ' LEU . 1.7 mm? -51.07 -50.29 58.98 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.09 0.774 . . . . 0.0 113.09 -178.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.987 ' HE2' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -69.44 -24.26 63.79 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -177.875 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.551 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 10.5 mmm-85 -61.94 -19.58 62.88 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.226 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.015 HD13 HD11 ' A' ' 463' ' ' LEU . 23.1 mt -66.08 -47.68 73.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.26 -179.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.551 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.5 t-20 56.96 59.37 7.83 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.547 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.551 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 84.4 Cg_endo -101.02 -157.96 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.375 0 C-N-CA 123.918 3.079 . . . . 0.0 111.465 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.08 139.66 53.02 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.082 179.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.62 135.75 36.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.258 0.551 . . . . 0.0 111.478 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 2.8 mtmt -154.72 160.08 41.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.733 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -104.97 108.9 20.65 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.902 0.382 . . . . 0.0 111.691 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.542 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.92 110.82 22.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.067 178.951 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 58.88 44.22 16.98 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.056 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.1 t70 74.32 8.1 4.57 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.47 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.45 ' O ' ' N ' ' A' ' 507' ' ' ILE . 1.5 tpmt? -113.48 130.79 56.25 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-O 120.651 0.262 . . . . 0.0 110.754 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 5.4 tpt -67.54 108.69 2.94 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.051 0.453 . . . . 0.0 110.994 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.614 ' CD2' HG22 ' A' ' 469' ' ' THR . 12.0 m170 -122.45 138.17 54.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.632 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.693 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -105.15 133.2 50.31 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.462 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -176.87 169.24 2.46 Favored 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.918 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.592 HD23 ' N ' ' A' ' 515' ' ' LEU . 1.3 pt? -129.76 168.9 15.84 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.196 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.406 ' H ' ' HD2' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -133.12 106.48 7.64 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.01 0.434 . . . . 0.0 111.438 179.78 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.714 ' HB2' HG22 ' A' ' 464' ' ' THR . 4.5 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.827 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.693 0.282 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -66.32 76.42 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.957 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.603 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -90.17 49.69 1.74 Allowed 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 120.903 0.382 . . . . 0.0 110.795 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.577 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 3.0 pp20? -86.25 -45.75 10.99 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.725 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . 0.587 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.6 OUTLIER -53.39 -22.23 7.22 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.752 -179.652 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 -50.48 -45.77 56.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.93 0.395 . . . . 0.0 111.354 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.719 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.9 p-80 -80.29 -21.88 42.18 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.351 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.943 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.7 tp -64.99 -28.99 69.89 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.324 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 77.9 mt -85.51 -32.71 7.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.719 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.58 -39.29 70.66 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.464 -0.495 . . . . 0.0 111.837 -179.243 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.815 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -70.72 -17.9 62.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.202 0.525 . . . . 0.0 110.081 -179.822 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.774 ' N ' HD13 ' B' ' 593' ' ' LEU . 3.8 pt-20 -63.21 -30.8 71.87 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.012 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.502 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 2.7 pt-20 -83.01 -43.0 16.86 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.696 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.9 pp -52.22 -26.59 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.196 0.522 . . . . 0.0 110.935 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.877 HD22 ' HG ' ' A' ' 497' ' ' LEU . 11.8 tp -69.56 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.336 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.694 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -144.24 30.72 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.974 0 CA-C-N 114.693 -1.139 . . . . 0.0 110.575 -178.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.502 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 54.9 mtp180 -138.68 43.68 2.1 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.141 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 30.1 m . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.137 179.989 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.828 0.347 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.887 HG22 ' H ' ' A' ' 453' ' ' GLN . 8.7 p -62.99 -147.16 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.356 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.887 ' H ' HG22 ' A' ' 452' ' ' VAL . 2.1 mm-40 91.26 114.61 0.03 OUTLIER 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 124.236 1.015 . . . . 0.0 109.078 -178.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.812 HG23 HG21 ' A' ' 482' ' ' THR . 19.3 t -57.72 117.93 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.674 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 26.3 p -131.55 173.39 11.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.644 0.735 . . . . 0.0 112.66 -178.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.669 ' HA ' HG23 ' A' ' 496' ' ' ILE . 15.1 mt-10 -68.04 -53.07 28.5 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.516 -1.22 . . . . 0.0 110.385 179.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.83 -28.8 62.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.192 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -70.04 -58.24 4.05 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.748 0.309 . . . . 0.0 111.347 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.806 HG13 HD11 ' A' ' 473' ' ' LEU . 19.2 t -51.75 -26.31 6.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.759 -179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.591 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.3 mmm-85 -63.09 -44.42 95.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.804 0.335 . . . . 0.0 110.336 179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.452 ' HG2' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -61.74 -24.98 67.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.504 179.684 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.507 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 4.0 m-30 -71.61 -46.37 59.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.998 0.428 . . . . 0.0 110.153 179.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.071 HD11 HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -65.91 -58.29 5.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.479 -179.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.742 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -50.46 -23.92 2.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.932 0.396 . . . . 0.0 110.599 179.788 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.5 mtt85 -94.11 -42.67 8.87 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.417 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.466 ' HD2' ' O ' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -173.36 156.28 2.85 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-O 120.766 0.317 . . . . 0.0 111.27 -179.737 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.615 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 71.8 Cg_endo -73.62 147.3 40.21 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.743 2.295 . . . . 0.0 113.463 -179.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.762 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -143.35 149.58 37.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.846 -179.702 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.626 HG22 ' O ' ' A' ' 511' ' ' MET . 12.1 p -90.14 177.37 6.46 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 107.622 -1.251 . . . . 0.0 107.622 176.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.87 HG22 ' CD2' ' A' ' 497' ' ' LEU . 0.5 OUTLIER -70.97 -34.96 71.92 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.147 -0.621 . . . . 0.0 111.06 -179.735 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.873 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -72.48 -49.5 32.69 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.661 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -60.77 -34.49 74.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.691 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.808 HD22 HD11 ' A' ' 493' ' ' LEU . 0.9 OUTLIER -64.19 -42.22 96.75 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.973 0.416 . . . . 0.0 110.9 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 1.026 HD22 HG22 ' A' ' 490' ' ' VAL . 3.0 pp -84.13 -33.06 24.37 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.741 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.636 ' N ' HD12 ' A' ' 474' ' ' LEU . 0.1 OUTLIER -49.06 -26.83 2.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.617 -179.252 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.456 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -86.09 -43.63 12.92 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.492 -179.825 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.621 ' CE2' HG22 ' A' ' 454' ' ' VAL . 5.4 m-85 -61.29 -40.16 93.13 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 121.112 0.482 . . . . 0.0 111.406 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -57.58 116.74 3.57 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.149 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 75.27 3.28 4.03 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.893 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.81 -54.41 6.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.881 0.372 . . . . 0.0 110.911 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? 177.1 -27.4 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.21 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.812 HG21 HG23 ' A' ' 454' ' ' VAL . 0.0 OUTLIER -47.03 -25.39 0.81 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.863 0.363 . . . . 0.0 111.079 179.532 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 66.65 15.19 63.83 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.653 -0.785 . . . . 0.0 111.856 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.999 HD23 HG11 ' A' ' 492' ' ' VAL . 1.1 mp -95.59 127.54 41.71 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 121.016 0.436 . . . . 0.0 111.028 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.78 155.21 0.05 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.709 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.5 m -60.63 -22.64 64.02 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.129 178.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.448 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 8.6 mt-10 -91.23 -44.93 8.92 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.61 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.752 ' O ' HG12 ' A' ' 492' ' ' VAL . 2.2 mt-30 -65.41 -40.62 93.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.115 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 70.2 m -51.02 -28.57 10.4 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.21 0.529 . . . . 0.0 109.595 178.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 1.026 HG22 HD22 ' A' ' 474' ' ' LEU . 14.4 t -84.97 -41.64 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.831 178.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . 0.463 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 7.1 t30 -60.96 -29.22 69.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.025 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.999 HG11 HD23 ' A' ' 484' ' ' LEU . 7.3 p -98.6 -7.25 9.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.924 179.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.808 HD11 HD22 ' A' ' 473' ' ' LEU . 39.2 tp -94.61 -46.89 6.76 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 121.029 0.442 . . . . 0.0 110.714 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.671 ' CB ' HD23 ' B' ' 593' ' ' LEU . . . -49.74 -34.12 18.11 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.401 -179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.7 OUTLIER -68.35 -44.07 76.09 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.72 -179.493 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.669 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.5 mt -79.39 -32.64 14.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.877 ' HG ' HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -44.12 -56.99 3.65 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -178.589 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.696 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.9 -33.36 71.75 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -178.097 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.575 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 14.3 mmm180 -56.64 -22.18 32.44 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.981 0.42 . . . . 0.0 110.814 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.071 HD22 HD11 ' A' ' 463' ' ' LEU . 93.6 mt -59.64 -47.6 84.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.89 -0.595 . . . . 0.0 112.171 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.595 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.0 t-20 58.36 57.48 6.41 Favored Pre-proline 0 C--N 1.32 -0.716 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.311 -179.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.595 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 56.5 Cg_endo -99.84 -159.69 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.111 0 C-N-CA 124.137 3.225 . . . . 0.0 111.363 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.8 139.78 52.65 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.771 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 5.3 ptt-85 -79.64 133.44 36.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.488 0.661 . . . . 0.0 111.5 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -156.25 160.21 39.58 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.664 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.403 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -103.86 110.39 22.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.995 0.426 . . . . 0.0 111.502 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.483 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.64 110.86 22.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.942 179.085 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.3 t30 59.8 43.13 15.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.841 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 73.28 12.36 4.85 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.35 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.413 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -116.1 131.38 56.96 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.866 179.826 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.626 ' O ' HG22 ' A' ' 469' ' ' THR . 28.9 mmm -62.9 108.49 1.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.061 0.457 . . . . 0.0 110.552 179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.493 ' CE1' HG23 ' A' ' 469' ' ' THR . 23.7 m80 -122.76 125.52 45.65 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.081 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.626 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -104.92 123.37 47.63 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 178.71 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.615 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER 179.43 169.37 1.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.08 0.467 . . . . 0.0 111.33 -178.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.791 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -118.78 168.7 10.5 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.641 178.547 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.43 ' N ' HD22 ' A' ' 515' ' ' LEU . 0.0 OUTLIER -136.9 106.05 6.0 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.082 0.467 . . . . 0.0 111.219 179.54 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.742 ' HG2' HG22 ' A' ' 464' ' ' THR . 3.2 pt-20 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.306 -0.854 . . . . 0.0 111.087 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.838 0.352 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.18 94.11 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.935 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.606 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -87.05 49.08 1.75 Allowed 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 120.906 0.384 . . . . 0.0 110.741 179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.469 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.7 pt-20 -86.54 -34.74 19.87 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.371 0.605 . . . . 0.0 110.288 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . 0.408 ' HA ' ' HB3' ' B' ' 590' ' ' LEU . 1.3 p-10 -84.25 -22.92 30.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.541 -179.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -56.15 -55.25 35.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.083 0.468 . . . . 0.0 111.699 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.692 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.5 p-80 -76.57 -21.97 54.93 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.319 -179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.925 ' CD1' HD21 ' A' ' 474' ' ' LEU . 19.5 tp -61.06 -29.32 69.67 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.452 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 82.6 mt -85.92 -34.4 8.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.692 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.4 OUTLIER -71.53 -40.74 69.87 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 120.51 -0.476 . . . . 0.0 112.163 -178.812 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.836 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.4 -18.62 65.46 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.211 0.529 . . . . 0.0 110.052 -179.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.536 ' N ' HD13 ' B' ' 593' ' ' LEU . 14.3 tt0 -63.62 -30.41 71.52 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.551 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.645 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.5 OUTLIER -77.52 -48.05 18.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.928 -0.578 . . . . 0.0 112.241 -178.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.856 HD11 ' HB1' ' A' ' 494' ' ' ALA . 1.6 pp -51.16 -26.68 5.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.103 0.478 . . . . 0.0 110.94 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.997 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.2 tp -62.48 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.541 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.696 HG22 ' HG ' ' B' ' 597' ' ' LEU . 34.9 m -136.1 37.13 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.06 0 CA-C-N 114.877 -1.056 . . . . 0.0 111.245 -177.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.645 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 17.3 mtp180 -129.71 102.05 6.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.062 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 28.2 m . . . . . 0 C--O 1.248 0.998 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.211 179.877 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.849 0.357 . . . . 0.0 111.296 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.736 ' O ' HG22 ' A' ' 482' ' ' THR . 7.2 p -173.45 144.29 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.984 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -124.13 135.34 53.44 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.813 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.617 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.1 t -60.3 116.85 1.94 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.802 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.521 ' O ' HG23 ' A' ' 459' ' ' VAL . 28.2 p -131.65 167.97 18.54 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-O 121.585 0.707 . . . . 0.0 112.533 -179.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.59 ' HA ' HG23 ' A' ' 496' ' ' ILE . 17.7 mt-10 -65.1 -54.87 23.33 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.188 178.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -50.59 -28.39 8.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.654 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.412 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -76.92 -35.83 57.06 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.762 -179.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.875 HG12 HD21 ' A' ' 500' ' ' LEU . 13.2 t -76.1 -31.89 22.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.709 0.29 . . . . 0.0 111.446 -179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.539 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.1 mmm180 -61.43 -41.24 96.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.211 179.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.454 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -65.81 -29.01 69.42 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.407 179.275 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.454 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 11.4 m-30 -64.3 -45.74 86.66 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.051 HD11 HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -64.56 -59.05 4.75 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.876 179.534 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.639 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.82 -26.6 1.7 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.234 179.461 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -88.89 -49.32 6.87 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.809 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.446 ' HD3' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -171.78 162.81 4.72 Favored Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.114 179.692 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.504 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 97.4 Cg_endo -80.37 160.08 22.82 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.763 2.309 . . . . 0.0 113.292 -179.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.631 ' HE3' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -157.21 168.2 28.11 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.369 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.589 HG22 ' CD2' ' A' ' 512' ' ' HIS . 4.6 p -100.75 176.1 5.42 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 176.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.429 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -71.33 -30.85 66.69 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 119.992 -0.683 . . . . 0.0 111.401 -179.778 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.856 ' HB3' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -77.17 -50.17 13.56 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.569 0.699 . . . . 0.0 109.388 178.53 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -57.91 -31.4 66.73 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.85 -1.068 . . . . 0.0 111.12 179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.644 HD11 HG13 ' A' ' 459' ' ' VAL . 0.9 OUTLIER -70.49 -39.22 74.31 Favored 'General case' 0 N--CA 1.461 0.094 0 CA-C-O 120.989 0.423 . . . . 0.0 110.664 179.852 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.925 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.1 pp -84.2 -33.15 24.22 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.938 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.581 ' N ' HD12 ' A' ' 474' ' ' LEU . 0.0 OUTLIER -47.42 -27.67 1.79 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.372 -179.058 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.452 ' HE3' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -85.35 -43.08 13.99 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.171 179.853 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.617 ' CE2' HG22 ' A' ' 454' ' ' VAL . 10.0 m-85 -64.38 -42.04 96.35 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.109 0.48 . . . . 0.0 111.26 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . 0.604 ' O ' HG22 ' A' ' 479' ' ' THR . 30.4 mt-30 -54.06 113.99 1.44 Allowed 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.042 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . 0.604 HG22 ' O ' ' A' ' 478' ' ' GLN . 0.5 OUTLIER 76.75 3.18 3.42 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.495 179.956 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 5.2 tptt -64.55 -54.19 36.02 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.815 0.341 . . . . 0.0 110.876 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . 0.694 ' HB3' HG12 ' A' ' 452' ' ' VAL . 0.0 OUTLIER 178.14 -30.1 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.255 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.736 HG22 ' O ' ' A' ' 452' ' ' VAL . 8.1 p -50.96 -21.91 2.0 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.041 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 65.45 16.31 62.73 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.815 -179.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.828 ' CD2' HG11 ' A' ' 492' ' ' VAL . 0.7 OUTLIER -86.05 130.05 34.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 120.937 0.398 . . . . 0.0 111.131 -179.697 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -43.9 149.93 0.29 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.669 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.76 -21.65 61.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.467 179.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.431 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 12.6 mt-10 -91.59 -49.17 6.44 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.716 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.628 ' O ' HG12 ' A' ' 492' ' ' VAL . 6.7 mt-30 -62.57 -42.09 99.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.31 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 87.1 m -49.11 -29.6 5.47 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 121.246 0.546 . . . . 0.0 109.692 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.883 HG22 HD22 ' A' ' 474' ' ' LEU . 13.7 t -83.12 -41.99 17.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.061 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -59.81 -31.97 70.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.063 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.828 HG11 ' CD2' ' A' ' 484' ' ' LEU . 7.6 p -94.86 -11.62 8.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.825 179.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.642 HD11 HD22 ' A' ' 497' ' ' LEU . 11.5 tp -90.22 -44.89 9.44 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.926 0.393 . . . . 0.0 110.777 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.856 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -50.76 -33.9 25.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.569 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.505 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -67.81 -40.56 83.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.789 -179.279 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.59 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.7 mt -77.99 -43.42 28.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -179.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.997 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.2 OUTLIER -37.77 -56.24 1.1 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -178.466 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.698 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.78 -23.56 63.38 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -178.557 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.488 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 0.1 OUTLIER -64.74 -18.53 65.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.137 0.494 . . . . 0.0 110.204 179.114 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.051 HD22 HD11 ' A' ' 463' ' ' LEU . 29.9 mt -59.7 -47.59 85.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.104 -179.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.644 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 27.8 t-20 56.63 54.99 8.24 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.287 -179.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.644 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.2 Cg_endo -101.41 -160.27 0.04 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 124.249 3.3 . . . . 0.0 111.67 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.75 141.29 48.76 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.658 178.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.64 133.55 36.4 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.4 0.619 . . . . 0.0 111.512 -178.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt -156.29 160.18 39.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.007 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -105.12 109.78 21.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.866 0.365 . . . . 0.0 111.347 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.498 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -90.73 110.86 22.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.021 179.071 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 58.6 t30 58.88 44.91 15.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.804 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.2 t70 71.57 13.24 6.4 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.201 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.401 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.09 127.59 54.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.636 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.16 108.51 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.921 0.391 . . . . 0.0 110.438 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.589 ' CD2' HG22 ' A' ' 469' ' ' THR . 9.0 m-70 -122.47 128.22 50.58 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.946 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.636 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -104.89 122.88 46.71 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.733 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.504 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER 179.25 169.33 1.01 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.069 0.461 . . . . 0.0 111.437 -178.757 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.79 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -120.34 168.88 10.83 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.521 178.331 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.01 106.15 7.09 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.136 0.494 . . . . 0.0 111.204 179.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.639 ' HG2' HG22 ' A' ' 464' ' ' THR . 2.7 pt-20 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.057 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 11.6 pm0 . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.833 0.349 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.94 100.02 0.19 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.085 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.868 ' O3P' HG22 ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . 0.403 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 3.3 t70 -90.17 49.67 1.74 Allowed 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 120.956 0.408 . . . . 0.0 110.617 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.443 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.2 pt-20 -86.13 -38.26 17.92 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.771 179.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.15 -22.68 33.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.597 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -50.93 -55.21 18.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.953 0.406 . . . . 0.0 111.719 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.659 ' O ' HD12 ' B' ' 593' ' ' LEU . 0.5 OUTLIER -80.11 -21.9 42.75 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.164 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.9 ' CD1' HD21 ' A' ' 474' ' ' LEU . 39.7 tp -54.43 -47.6 72.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.004 0.43 . . . . 0.0 110.859 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 48.9 mt -86.24 -29.6 6.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.785 179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.584 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.06 -45.46 77.29 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.387 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 1.111 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -67.96 -20.34 65.05 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 179.172 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.623 ' N ' HD13 ' B' ' 593' ' ' LEU . 5.8 tt0 -63.44 -30.86 71.92 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.323 179.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.435 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.3 OUTLIER -70.83 -45.83 63.85 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.532 -179.537 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 1.059 HD11 ' HB1' ' A' ' 494' ' ' ALA . 5.1 pt -58.14 -26.62 29.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.307 0.575 . . . . 0.0 110.678 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.874 HD13 ' HB3' ' A' ' 497' ' ' LEU . 12.2 tp -72.31 -81.74 0.05 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.1 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.754 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.7 m -141.76 30.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.059 0 CA-C-N 114.668 -1.151 . . . . 0.0 110.593 -177.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.435 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 7.0 mtp180 -138.82 39.0 2.18 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.272 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 600' ' ' VAL . 27.4 m . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.195 -0.907 . . . . 0.0 111.168 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.755 0.312 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.764 ' O ' HG22 ' A' ' 482' ' ' THR . 7.4 p -63.62 123.13 15.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.923 0.392 . . . . 0.0 111.148 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.46 133.42 53.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.195 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.764 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.2 t -63.92 121.86 13.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.382 179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 459' ' ' VAL . 35.0 p -131.49 170.71 14.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.689 0.757 . . . . 0.0 112.779 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.733 ' HA ' HG23 ' A' ' 496' ' ' ILE . 23.8 mt-10 -69.06 -52.97 22.98 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.328 -1.305 . . . . 0.0 110.73 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.92 -27.5 68.86 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.314 -179.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.466 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -69.71 -36.71 76.15 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.458 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.879 ' HB ' HD21 ' A' ' 500' ' ' LEU . 15.6 t -70.67 -36.92 67.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.808 0.337 . . . . 0.0 110.911 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.583 ' HD3' HD23 ' A' ' 500' ' ' LEU . 1.5 mmm-85 -52.76 -49.56 65.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.953 178.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.532 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -61.66 -23.74 66.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.014 179.8 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.54 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 8.4 m-30 -75.17 -42.62 55.57 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.223 0.535 . . . . 0.0 109.605 178.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.04 HD11 HD13 ' A' ' 500' ' ' LEU . 1.8 mt -69.46 -57.66 4.97 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.454 -179.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.672 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.1 OUTLIER -48.28 -27.58 2.58 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.091 0.472 . . . . 0.0 110.364 179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.656 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 15.2 mtt180 -83.96 -55.75 4.06 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.517 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.656 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER -163.72 146.37 7.78 Favored Pre-proline 0 CA--C 1.533 0.323 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.657 -179.936 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.577 ' HG2' HG13 ' A' ' 507' ' ' ILE . 43.9 Cg_endo -68.1 161.52 44.05 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.64 2.227 . . . . 0.0 113.139 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.595 ' CE ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -159.64 166.61 30.28 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.567 -179.227 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.883 HG22 ' O ' ' A' ' 511' ' ' MET . 51.8 p -98.73 178.56 4.94 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 176.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 1.111 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -71.19 -40.74 71.02 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.612 179.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.783 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -64.47 -52.2 59.19 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.264 0.554 . . . . 0.0 109.852 179.013 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . 0.41 ' H ' ' HG2' ' A' ' 471' ' ' LYS . 46.3 t0 -59.94 -25.04 64.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.621 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.86 HD11 HG13 ' A' ' 459' ' ' VAL . 1.4 tt -86.13 -45.47 11.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.004 0.431 . . . . 0.0 111.616 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.9 HD21 ' CD1' ' B' ' 590' ' ' LEU . 3.6 pp -76.09 -44.1 40.36 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.945 -0.571 . . . . 0.0 112.087 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.557 ' N ' HD12 ' A' ' 474' ' ' LEU . 0.1 OUTLIER -52.34 -24.27 7.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.681 0.277 . . . . 0.0 111.204 -179.7 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.592 ' HG2' ' N ' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -76.99 -44.43 31.09 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.521 -179.424 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.764 ' CE2' HG22 ' A' ' 454' ' ' VAL . 9.1 m-85 -60.6 -48.41 81.92 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.593 0.711 . . . . 0.0 109.753 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . 0.492 ' O ' ' O ' ' A' ' 477' ' ' PHE . 3.2 mm-40 44.17 174.93 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.218 -1.355 . . . . 0.0 112.496 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . 0.57 HG23 ' C ' ' A' ' 484' ' ' LEU . 1.3 m -80.3 3.07 22.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.272 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.59 -58.05 3.71 Favored 'General case' 0 CA--C 1.528 0.124 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . 0.48 ' CB ' HG12 ' A' ' 452' ' ' VAL . 3.2 mppt? -118.84 -44.5 2.62 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -179.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.764 HG22 ' O ' ' A' ' 452' ' ' VAL . 16.2 p -51.51 -18.23 1.03 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.238 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 63.69 18.97 62.3 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.51 -0.853 . . . . 0.0 111.266 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.808 ' CD2' HG11 ' A' ' 492' ' ' VAL . 5.0 mp -107.04 122.67 46.92 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 120.963 0.411 . . . . 0.0 111.116 -179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.66 158.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.704 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 14.7 m -60.84 -27.2 67.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.127 0.489 . . . . 0.0 110.089 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.464 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 4.3 mt-10 -86.95 -46.63 9.69 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.415 179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.474 ' O ' HG12 ' A' ' 492' ' ' VAL . 4.2 mt-30 -63.2 -40.34 97.21 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.0 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 96.7 m -50.71 -28.07 8.32 Favored 'General case' 0 C--N 1.335 -0.058 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.746 HG13 HD22 ' A' ' 474' ' ' LEU . 4.6 t -82.05 -44.16 19.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.107 179.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -56.31 -25.85 50.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.754 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.808 HG11 ' CD2' ' A' ' 484' ' ' LEU . 6.9 p -100.31 -14.17 7.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.546 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.633 HD23 ' CB ' ' A' ' 474' ' ' LEU . 0.2 OUTLIER -91.0 -35.22 14.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.888 0.375 . . . . 0.0 110.91 -179.776 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 1.059 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -58.33 -38.54 77.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.273 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.6 OUTLIER -63.13 -40.83 98.72 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.424 -179.614 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.733 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.3 mt -79.02 -44.31 24.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.569 -178.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.874 ' HB3' HD13 ' B' ' 597' ' ' LEU . 2.3 mm? -41.15 -50.91 3.5 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 -178.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.888 ' NZ ' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -64.26 -33.17 75.21 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.873 0.368 . . . . 0.0 111.948 -178.768 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.469 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 0.7 OUTLIER -55.9 -23.3 30.53 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.003 -179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.04 HD13 HD11 ' A' ' 463' ' ' LEU . 56.8 mt -59.99 -47.54 85.42 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.924 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.547 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 24.9 t-20 58.13 59.94 6.18 Favored Pre-proline 0 C--N 1.32 -0.715 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.503 -178.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.547 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 84.7 Cg_endo -101.06 -157.29 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.306 0 C-N-CA 123.966 3.111 . . . . 0.0 111.419 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.01 140.44 51.91 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.012 179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.8 135.14 36.41 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.337 0.589 . . . . 0.0 111.579 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 14.7 mtmt -156.11 159.26 38.9 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.587 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.415 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -105.17 111.65 24.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.031 0.443 . . . . 0.0 111.722 -179.64 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.577 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.89 110.94 22.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.001 179.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 9.4 t30 58.62 42.96 19.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.836 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 74.45 12.38 3.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.391 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.435 ' O ' ' N ' ' A' ' 507' ' ' ILE . 0.0 OUTLIER -116.17 130.96 57.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.854 179.824 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.883 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.97 109.1 1.68 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.962 0.41 . . . . 0.0 111.022 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.563 ' CD2' HG23 ' A' ' 469' ' ' THR . 11.1 m170 -122.31 138.21 54.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.886 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.707 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.1 OUTLIER -111.13 128.33 55.86 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.114 179.408 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.539 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -179.89 169.24 1.28 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.239 0.542 . . . . 0.0 112.16 -179.097 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.684 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.2 pt? -122.03 169.19 11.08 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.206 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.6 106.62 8.3 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.418 179.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.672 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.107 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.837 0.351 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.4 86.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.988 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.619 ' O1P' HG21 ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -90.03 49.46 1.71 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 120.968 0.414 . . . . 0.0 110.737 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.473 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 11.9 pt-20 -86.19 -40.82 15.23 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.711 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' B' ' 590' ' ' LEU . 0.2 OUTLIER -84.45 -22.75 30.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.617 -179.464 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -52.06 -55.26 21.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.744 -179.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.711 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.2 p-80 -77.63 -21.86 51.61 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.251 -179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.953 ' CD1' HD21 ' A' ' 474' ' ' LEU . 23.4 tp -61.93 -29.46 70.24 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.344 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 76.0 mt -85.97 -34.64 8.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 112.894 0.701 . . . . 0.0 112.894 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.711 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.67 -43.54 65.84 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 120.346 -0.542 . . . . 0.0 112.065 -179.018 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 1.121 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -64.08 -18.85 64.79 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.166 -179.656 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.625 ' N ' HD13 ' B' ' 593' ' ' LEU . 3.7 pt-20 -63.55 -30.74 71.81 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.002 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.721 ' OE1' HG23 ' B' ' 600' ' ' VAL . 0.3 OUTLIER -74.8 -48.48 25.14 Favored 'General case' 0 N--CA 1.462 0.136 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.97 -179.357 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.621 HG13 ' O ' ' B' ' 593' ' ' LEU . 2.1 pp -53.72 -26.52 13.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.275 0.559 . . . . 0.0 110.721 179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.942 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.1 tp -71.85 -82.44 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.969 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.718 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.4 m -141.66 30.53 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.041 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.76 -177.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.459 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.2 OUTLIER -139.17 37.99 2.11 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.396 -179.633 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . 0.721 HG23 ' OE1' ' B' ' 595' ' ' GLU . 9.4 p . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.052 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.911 0.386 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.606 ' C ' HG22 ' A' ' 482' ' ' THR . 39.5 t -60.07 158.85 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.141 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.498 ' N ' HG12 ' A' ' 452' ' ' VAL . 0.0 OUTLIER -149.92 132.33 15.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.696 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.624 HG22 ' CE2' ' A' ' 477' ' ' PHE . 3.9 t -79.99 110.33 15.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.693 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.507 ' O ' HG23 ' A' ' 459' ' ' VAL . 32.5 p -131.77 168.14 18.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.68 0.752 . . . . 0.0 112.578 -179.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.757 ' HA ' HG23 ' A' ' 496' ' ' ILE . 20.9 mt-10 -61.59 -53.33 57.65 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.359 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.41 ' HA ' ' HG2' ' A' ' 460' ' ' ARG . 0.2 OUTLIER -64.12 -27.86 69.38 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.237 -179.257 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.438 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -68.54 -35.81 77.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.363 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.899 ' HB ' HD21 ' A' ' 500' ' ' LEU . 19.0 t -73.52 -35.38 44.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 120.903 0.383 . . . . 0.0 110.865 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.62 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -52.98 -51.36 61.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.816 178.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.513 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -56.15 -30.33 62.02 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.794 179.693 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.704 ' HH ' ' HZ ' ' A' ' 477' ' ' PHE . 11.0 m-30 -71.25 -41.71 69.75 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.081 0.467 . . . . 0.0 110.205 179.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.019 HD11 HD13 ' A' ' 500' ' ' LEU . 1.9 mt -70.8 -58.96 3.09 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.446 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.704 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.56 -27.75 2.97 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 121.048 0.451 . . . . 0.0 110.756 -179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 9.1 ttt-85 -85.91 -52.14 5.92 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.887 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -166.48 130.49 1.62 Allowed Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.904 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.512 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 12.2 Cg_endo -55.0 160.76 7.42 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.62 2.213 . . . . 0.0 112.708 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.713 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -154.23 178.0 10.49 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.457 0.646 . . . . 0.0 111.718 -179.156 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.729 HG22 ' CD2' ' A' ' 512' ' ' HIS . 1.3 p -111.24 159.54 17.81 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 177.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 1.121 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -53.9 -48.09 70.49 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.539 -179.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.794 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -56.98 -53.45 57.88 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.251 179.555 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 28.4 t0 -62.65 -33.47 75.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.727 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.797 HD11 HG13 ' A' ' 459' ' ' VAL . 1.3 tt -70.53 -41.65 72.29 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 121.093 0.473 . . . . 0.0 111.418 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.953 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.4 pp -84.19 -37.3 22.03 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.725 -0.671 . . . . 0.0 112.241 -179.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.07 -40.45 61.19 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.749 0.309 . . . . 0.0 111.219 -179.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.447 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -61.97 -41.68 98.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.138 -179.842 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.704 ' HZ ' ' HH ' ' A' ' 462' ' ' TYR . 13.3 m-85 -65.95 -66.08 0.59 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.507 0.67 . . . . 0.0 110.464 179.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 52.11 174.28 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.323 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 11.7 t -74.06 -15.43 61.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.221 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.29 -8.25 53.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.572 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . 0.403 ' HD2' HG21 ' A' ' 452' ' ' VAL . 46.7 mmtt -119.75 -73.9 0.63 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.73 0.3 . . . . 0.0 111.507 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.606 HG22 ' C ' ' A' ' 452' ' ' VAL . 71.3 p -78.52 13.13 1.7 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.384 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 54.97 22.39 27.49 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.479 -0.867 . . . . 0.0 111.775 -179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.701 HD13 HG11 ' A' ' 492' ' ' VAL . 1.0 OUTLIER -104.97 123.47 47.83 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 120.997 0.427 . . . . 0.0 111.337 -179.305 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.92 158.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.582 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . 0.494 ' O ' HG23 ' A' ' 490' ' ' VAL . 12.2 p -62.0 -25.03 67.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.971 178.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.427 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 18.6 mt-10 -89.0 -51.15 5.75 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.354 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.514 ' HB3' HD23 ' A' ' 484' ' ' LEU . 0.1 OUTLIER -60.2 -42.93 96.13 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.237 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 47.9 m -49.55 -37.69 28.14 Favored 'General case' 0 CA--C 1.522 -0.12 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 179.082 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.577 HG12 ' HG ' ' B' ' 593' ' ' LEU . 2.7 t -71.19 -46.75 64.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.065 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -55.79 -25.83 43.15 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.567 179.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.701 HG11 HD13 ' A' ' 484' ' ' LEU . 9.1 p -101.75 -14.48 8.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.541 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.922 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.1 OUTLIER -91.41 -35.74 14.2 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 120.968 0.414 . . . . 0.0 110.543 179.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.611 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -56.44 -37.01 69.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.092 179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.498 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.38 -41.49 80.5 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.768 -179.473 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.757 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.2 mt -77.35 -39.37 27.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.094 -179.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.942 ' HB3' HD13 ' B' ' 597' ' ' LEU . 1.4 mm? -42.73 -59.26 2.0 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.65 ' HA ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -60.04 -30.89 69.49 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -178.798 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.405 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 0.4 OUTLIER -56.52 -23.76 41.88 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.877 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.019 HD13 HD11 ' A' ' 463' ' ' LEU . 55.9 mt -61.43 -47.49 85.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.756 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.567 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 58.78 59.41 5.6 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.598 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.567 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 77.3 Cg_endo -101.22 -159.32 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.356 0 C-N-CA 123.996 3.131 . . . . 0.0 111.555 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.77 139.87 52.5 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.724 178.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 11.6 ptt180 -79.64 133.94 36.42 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.411 0.624 . . . . 0.0 111.592 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 19.2 mtmt -156.3 159.86 39.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.569 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.409 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 0.1 OUTLIER -105.17 111.83 24.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.965 0.412 . . . . 0.0 111.656 -179.769 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.494 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.5 OUTLIER -90.79 110.92 22.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.976 178.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 58.73 42.87 19.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.818 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . 0.409 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 0.4 OUTLIER 74.58 12.76 3.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.353 -179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' A' ' 507' ' ' ILE . 0.0 OUTLIER -116.22 129.25 56.2 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.681 0.276 . . . . 0.0 110.94 179.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 2.9 tpt -62.13 108.57 1.09 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.013 0.435 . . . . 0.0 110.643 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.729 ' CD2' HG22 ' A' ' 469' ' ' THR . 10.8 m170 -122.64 126.98 48.74 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.137 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.72 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.08 123.75 48.5 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.902 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.707 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.4 OUTLIER -178.94 169.51 1.57 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.158 0.504 . . . . 0.0 112.062 -178.598 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.755 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.4 pt? -116.07 169.15 9.48 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.332 178.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.403 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -136.48 106.67 6.37 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.996 0.427 . . . . 0.0 111.429 179.706 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.704 ' HG2' HG22 ' A' ' 464' ' ' THR . 4.9 pt-20 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.151 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.82 0.343 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -64.38 81.0 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.965 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.598 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -90.09 48.99 1.64 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 120.99 0.424 . . . . 0.0 110.624 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.536 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.6 pt-20 -86.47 -47.75 9.01 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.331 179.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -53.7 -22.66 9.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.52 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -52.9 -45.7 67.67 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.017 0.437 . . . . 0.0 111.25 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.536 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 2.2 p-80 -80.03 -23.43 41.44 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.077 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.941 HD12 HD21 ' A' ' 474' ' ' LEU . 27.3 tp -68.05 -38.85 82.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.801 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.4 mt -85.88 -29.64 6.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.612 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.76 -43.23 80.32 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.786 -179.455 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.795 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -71.35 -18.16 62.39 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.081 0.467 . . . . 0.0 110.196 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.764 ' N ' HD13 ' B' ' 593' ' ' LEU . 2.4 pt-20 -63.03 -31.67 72.86 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.469 179.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.448 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 1.0 OUTLIER -76.95 -49.35 15.73 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.776 -179.364 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.629 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -54.8 -26.54 17.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.155 0.502 . . . . 0.0 110.83 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.95 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.8 tp -69.0 -83.36 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.92 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.66 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.2 m -141.35 30.72 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.027 0 CA-C-N 114.656 -1.157 . . . . 0.0 110.707 -177.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.448 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 54.2 mtp180 -138.33 52.45 1.83 Allowed 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.28 -179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 31.5 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.104 179.938 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.898 0.38 . . . . 0.0 111.206 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . . . . . . . . . 5.1 m -68.52 -171.52 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.242 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -142.01 133.88 27.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.581 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.659 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.0 t -61.88 115.73 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.019 0.437 . . . . 0.0 110.905 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.549 ' O ' HG23 ' A' ' 459' ' ' VAL . 27.5 p -131.79 172.18 12.61 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.586 0.707 . . . . 0.0 112.575 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.621 ' HA ' HG23 ' A' ' 496' ' ' ILE . 17.0 mt-10 -69.04 -54.82 13.07 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.475 -1.239 . . . . 0.0 110.05 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.04 -27.07 7.12 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.46 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -75.91 -37.92 58.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.752 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.74 HG13 HD11 ' A' ' 473' ' ' LEU . 6.6 t -74.57 -40.81 48.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.863 0.364 . . . . 0.0 111.428 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.717 ' CD ' HD23 ' A' ' 500' ' ' LEU . 2.4 mmm-85 -54.43 -39.53 67.46 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.232 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.1 OUTLIER -71.01 -26.66 63.22 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.761 179.48 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.516 ' HH ' ' HZ ' ' A' ' 477' ' ' PHE . 15.6 m-30 -67.59 -36.96 81.86 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.132 0.491 . . . . 0.0 109.918 179.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.028 HD11 HD22 ' A' ' 500' ' ' LEU . 0.6 OUTLIER -74.84 -58.53 3.23 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.082 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.679 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.42 -28.26 2.04 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-O 121.15 0.5 . . . . 0.0 110.398 179.744 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 37.7 mtt85 -85.36 -48.58 8.9 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.561 179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -173.48 130.21 0.54 Allowed Pre-proline 0 CA--C 1.532 0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.984 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.505 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 11.2 Cg_endo -53.65 157.18 10.25 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.753 2.302 . . . . 0.0 112.576 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.664 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.95 172.24 16.0 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 121.405 0.622 . . . . 0.0 111.694 -179.415 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.891 HG22 ' O ' ' A' ' 511' ' ' MET . 35.1 p -103.73 160.69 14.56 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 177.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.557 ' CG2' HD21 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -54.52 -43.72 72.14 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.057 -0.657 . . . . 0.0 110.487 179.944 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.855 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -61.24 -59.12 5.8 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.797 178.871 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -56.85 -20.44 22.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.581 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.74 HD11 HG13 ' A' ' 459' ' ' VAL . 1.6 tt -87.87 -42.4 12.55 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.015 0.436 . . . . 0.0 111.446 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.959 ' HB3' HD23 ' A' ' 493' ' ' LEU . 2.0 pp -84.38 -48.04 10.08 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.144 -179.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 32.6 mmtt -48.83 -29.84 5.08 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -179.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.446 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -68.52 -41.68 79.61 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.932 -179.841 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.659 ' CE2' HG22 ' A' ' 454' ' ' VAL . 11.5 m-85 -66.47 -30.04 70.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 111.021 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -56.65 113.84 1.8 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.8 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 3.1 m 74.1 3.28 4.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.392 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 1.1 tptt -63.44 -54.47 36.11 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.823 0.344 . . . . 0.0 110.896 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.28 -33.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.229 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . . . . . . . . . 14.8 p -54.42 -18.49 4.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.147 179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 64.88 17.39 62.96 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.599 -0.81 . . . . 0.0 111.857 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.911 ' CD2' HG11 ' A' ' 492' ' ' VAL . 1.6 tp -84.58 129.95 34.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.011 0.434 . . . . 0.0 111.088 -179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -45.33 151.29 0.37 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.66 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 m -59.96 -24.71 64.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.454 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.426 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 4.3 mt-10 -91.35 -45.78 8.39 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.553 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.764 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.5 mt-30 -63.46 -41.32 98.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.077 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.497 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 85.6 m -50.32 -30.28 11.69 Favored 'General case' 0 C--N 1.334 -0.087 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.807 HG22 HD13 ' A' ' 474' ' ' LEU . 5.0 t -83.62 -39.85 15.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.989 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . 0.426 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 4.9 t30 -61.04 -31.17 70.82 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.907 179.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.911 HG11 ' CD2' ' A' ' 484' ' ' LEU . 4.0 p -97.1 -12.49 8.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.861 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.959 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.3 OUTLIER -91.06 -40.9 11.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.176 0.512 . . . . 0.0 110.024 179.409 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.696 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -50.28 -36.64 32.35 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.257 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.9 OUTLIER -66.9 -42.87 84.76 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.297 -179.607 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.621 HG23 ' HA ' ' A' ' 456' ' ' GLU . 7.1 mt -77.74 -43.79 29.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.468 -178.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.95 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -36.05 -57.67 0.69 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.729 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.664 ' HA ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -62.52 -22.77 66.55 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.29 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.514 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 1.4 mmp_? -60.14 -19.88 55.74 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.937 0.399 . . . . 0.0 110.69 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.028 HD22 HD11 ' A' ' 463' ' ' LEU . 16.4 mt -64.46 -47.92 77.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.044 -179.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.582 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 56.81 59.07 8.21 Favored Pre-proline 0 C--N 1.318 -0.798 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.403 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.582 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 73.9 Cg_endo -101.09 -160.22 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 124.02 3.147 . . . . 0.0 111.669 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.76 141.03 49.83 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.681 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -79.53 134.82 36.5 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.291 0.567 . . . . 0.0 111.591 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 10.9 mtmt -156.08 160.2 39.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.608 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -103.41 109.96 21.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.977 0.418 . . . . 0.0 111.699 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.515 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.73 110.81 22.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.869 178.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 58.35 44.53 18.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.975 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.5 t0 72.83 11.8 5.31 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.478 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 507' ' ' ILE . 1.8 tpmt? -116.08 128.81 55.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.606 0.241 . . . . 0.0 110.701 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.891 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -62.86 108.63 1.23 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.953 0.406 . . . . 0.0 110.581 180.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.806 ' CD2' HG23 ' A' ' 469' ' ' THR . 10.4 m170 -122.56 129.47 51.96 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.825 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.596 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -108.91 123.47 49.13 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.775 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.764 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.5 OUTLIER -177.89 169.34 2.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.059 0.457 . . . . 0.0 111.959 -178.57 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.737 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.5 pt? -114.12 169.13 9.25 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.468 179.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.4 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -137.57 106.71 6.02 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.052 0.453 . . . . 0.0 111.499 179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.679 ' HG2' HG22 ' A' ' 464' ' ' THR . 3.8 pt-20 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.328 -0.844 . . . . 0.0 111.171 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.847 0.356 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -60.24 99.99 0.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.887 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.595 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -90.1 48.97 1.63 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.976 0.417 . . . . 0.0 110.56 179.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.533 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.5 pt-20 -86.45 -46.98 9.71 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.415 179.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -53.66 -22.61 9.19 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.582 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -51.76 -47.15 64.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.033 0.444 . . . . 0.0 110.976 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.533 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 2.3 p-80 -80.13 -25.06 40.07 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.04 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.892 ' CD1' HD21 ' A' ' 474' ' ' LEU . 21.5 tp -58.94 -29.96 67.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.839 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 80.5 mt -85.86 -29.7 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.229 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.574 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -65.58 -38.13 88.64 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.799 -179.291 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.83 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.98 -17.9 54.6 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.153 0.502 . . . . 0.0 110.106 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.804 ' N ' HD13 ' B' ' 593' ' ' LEU . 1.1 pt-20 -61.8 -31.27 71.48 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.817 179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.514 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 8.3 pt-20 -82.49 -47.13 12.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.406 -178.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.687 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.1 pp -51.76 -26.74 7.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.018 0.437 . . . . 0.0 111.219 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.922 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.4 tp -68.47 -83.33 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.58 0.705 . . . . 0.0 111.516 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.674 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m -140.93 30.39 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.115 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.43 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.514 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 33.7 mtp85 -142.41 43.68 1.64 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.117 -179.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 31.1 m . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.172 179.933 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.814 0.34 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.872 ' O ' HG23 ' A' ' 482' ' ' THR . 12.7 m -156.91 -168.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.895 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.529 ' HA ' HG22 ' A' ' 482' ' ' THR . 7.5 mp0 -54.47 122.09 9.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.824 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.553 HG22 ' CD2' ' A' ' 477' ' ' PHE . 4.6 t -63.9 115.94 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.707 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.724 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.6 p -131.58 159.65 37.6 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.552 0.692 . . . . 0.0 112.644 -179.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.654 ' HA ' HG23 ' A' ' 496' ' ' ILE . 19.8 mt-10 -54.73 -54.69 38.58 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.505 178.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -54.34 -28.35 42.24 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.924 -179.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.416 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -80.22 -33.14 38.31 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.968 -179.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.724 HG23 ' O ' ' A' ' 455' ' ' THR . 2.8 t -75.8 -36.04 32.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 120.768 0.318 . . . . 0.0 111.472 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.609 ' HD3' HD23 ' A' ' 500' ' ' LEU . 2.3 mmm-85 -57.46 -38.62 74.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.919 0.39 . . . . 0.0 110.088 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.453 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -70.31 -29.12 65.76 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.562 179.298 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.453 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 7.1 m-30 -64.83 -38.78 92.13 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.14 0.495 . . . . 0.0 109.813 179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.079 HD11 HD22 ' A' ' 500' ' ' LEU . 0.3 OUTLIER -73.97 -58.27 3.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.193 -179.63 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.764 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.89 -27.8 2.31 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 121.143 0.497 . . . . 0.0 110.478 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -87.57 -49.73 6.98 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.792 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.41 ' HA ' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -169.28 125.98 0.79 Allowed Pre-proline 0 CA--C 1.532 0.281 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.138 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.551 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 9.2 Cg_endo -52.14 158.42 5.16 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.707 2.271 . . . . 0.0 112.878 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.681 ' CE ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -151.13 168.46 24.58 Favored 'General case' 0 N--CA 1.461 0.115 0 CA-C-O 121.451 0.643 . . . . 0.0 111.968 -179.528 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.635 HG22 ' CD2' ' A' ' 512' ' ' HIS . 2.1 p -100.9 176.37 5.3 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 176.696 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.473 ' CG2' HD21 ' B' ' 593' ' ' LEU . 0.1 OUTLIER -71.04 -41.51 70.71 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 119.781 -0.767 . . . . 0.0 110.616 179.655 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.858 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -64.62 -49.69 70.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.669 178.659 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . 0.544 ' HA ' ' HD3' ' A' ' 475' ' ' LYS . 11.5 t70 -59.13 -40.1 84.39 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.247 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.69 HD11 ' CG1' ' A' ' 459' ' ' VAL . 1.0 OUTLIER -62.15 -41.27 98.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.096 0.474 . . . . 0.0 111.137 -179.599 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.892 HD21 ' CD1' ' B' ' 590' ' ' LEU . 1.0 OUTLIER -84.46 -26.03 28.49 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.895 -0.593 . . . . 0.0 112.314 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.544 ' HD3' ' HA ' ' A' ' 472' ' ' ASP . 0.0 OUTLIER -54.85 -36.51 65.13 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.577 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.499 ' CE ' ' HA ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -81.38 -43.75 18.55 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.063 -179.987 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.553 ' CD2' HG22 ' A' ' 454' ' ' VAL . 11.5 m-85 -65.98 -27.32 68.05 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.288 0.566 . . . . 0.0 109.857 178.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -64.02 113.77 3.71 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.299 -0.864 . . . . 0.0 111.128 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 72.85 3.36 4.67 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 112.119 179.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -70.43 -48.31 56.58 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.824 0.345 . . . . 0.0 111.369 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.1 tptp -179.43 -27.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.447 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.872 HG23 ' O ' ' A' ' 452' ' ' VAL . 0.0 OUTLIER -45.51 -26.2 0.54 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.844 0.354 . . . . 0.0 110.987 179.698 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 62.86 16.4 56.69 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.497 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.826 ' CD2' HG11 ' A' ' 492' ' ' VAL . 3.3 mp -95.47 129.67 42.55 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 121.004 0.431 . . . . 0.0 111.091 -179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -39.53 155.06 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.636 179.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 2.2 p -62.7 -20.39 64.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.463 179.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.415 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 4.0 mt-10 -95.48 -39.95 9.72 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.748 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.624 ' O ' HG12 ' A' ' 492' ' ' VAL . 14.0 mt-30 -69.26 -43.76 73.29 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.568 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 90.1 m -49.18 -28.99 4.93 Favored 'General case' 0 N--CA 1.461 0.1 0 CA-C-O 121.271 0.558 . . . . 0.0 109.839 178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.622 HG22 HD22 ' A' ' 474' ' ' LEU . 17.4 t -84.28 -39.98 15.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.631 178.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . 0.46 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 9.4 t30 -60.99 -29.91 69.97 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.06 -0.973 . . . . 0.0 109.975 178.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.826 HG11 ' CD2' ' A' ' 484' ' ' LEU . 7.6 p -97.48 -13.14 8.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.938 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.834 HD23 ' HB3' ' A' ' 474' ' ' LEU . 5.6 tp -90.95 -43.76 9.77 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 121.129 0.49 . . . . 0.0 110.107 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.717 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -49.29 -33.87 14.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.543 179.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.9 OUTLIER -69.09 -43.19 75.0 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.877 -179.197 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.654 HG23 ' HA ' ' A' ' 456' ' ' GLU . 6.4 mt -78.93 -32.43 15.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -178.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.922 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -46.05 -57.72 4.21 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -178.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.687 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.96 -29.19 68.25 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -178.26 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.553 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 4.0 mmm180 -58.29 -22.08 51.46 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.91 0.386 . . . . 0.0 110.681 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.079 HD22 HD11 ' A' ' 463' ' ' LEU . 65.2 mt -58.74 -47.62 83.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.529 -179.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.615 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.1 t-20 56.48 57.45 9.02 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.507 -179.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.615 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 57.9 Cg_endo -101.74 -163.26 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.44 0 C-N-CA 124.175 3.25 . . . . 0.0 111.843 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . 0.406 ' O ' ' CD ' ' A' ' 505' ' ' LYS . 0.1 OUTLIER -116.39 145.07 43.52 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.038 178.51 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -83.24 132.91 35.02 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.404 0.621 . . . . 0.0 111.985 -178.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.406 ' CD ' ' O ' ' A' ' 503' ' ' GLU . 0.0 OUTLIER -150.32 159.67 44.29 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.455 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.461 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 0.0 OUTLIER -105.1 112.17 25.21 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.554 -0.458 . . . . 0.0 111.605 -179.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.468 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.7 OUTLIER -90.89 110.92 22.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.025 179.237 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.7 t30 58.85 41.99 20.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.764 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . 0.461 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 1.3 t70 74.37 14.89 3.58 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.252 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.447 ' O ' ' HA ' ' A' ' 506' ' ' MET . 0.0 OUTLIER -116.26 131.61 56.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.713 0.292 . . . . 0.0 110.908 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.488 ' HA ' ' HE3' ' A' ' 511' ' ' MET . 3.7 tpt -62.54 108.4 1.13 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.93 0.395 . . . . 0.0 110.687 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.635 ' CD2' HG22 ' A' ' 469' ' ' THR . 10.4 m170 -122.84 128.81 50.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.408 179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.639 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.73 123.36 48.02 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 178.701 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.813 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.6 OUTLIER 179.11 169.13 0.97 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.107 0.48 . . . . 0.0 111.985 -178.857 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.758 ' CD2' HD12 ' A' ' 463' ' ' LEU . 1.6 pt? -114.04 169.17 9.21 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.382 178.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.42 ' N ' ' CD ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -142.42 106.52 4.74 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.083 0.468 . . . . 0.0 111.382 179.781 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.764 ' HB2' HG22 ' A' ' 464' ' ' THR . 2.7 mm-40 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.847 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.864 0.364 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -60.48 86.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.917 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.666 HG21 ' O3P' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . 0.402 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 15.6 t70 -90.07 49.37 1.7 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.95 0.405 . . . . 0.0 110.704 179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.482 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 3.1 pp20? -86.38 -40.54 15.31 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.836 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.37 -22.75 30.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.763 -179.274 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -53.33 -55.21 26.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.011 0.434 . . . . 0.0 111.73 -179.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.677 ' HA ' ' CD2' ' B' ' 592' ' ' TYR . 1.2 p-80 -77.08 -21.63 54.05 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.334 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 1.078 HD13 HD21 ' A' ' 474' ' ' LEU . 24.3 tp -60.6 -29.52 69.26 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.544 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 79.0 mt -85.75 -34.32 8.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -178.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.677 ' CD2' ' HA ' ' B' ' 589' ' ' HIS . 0.3 OUTLIER -71.78 -40.89 68.93 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 120.359 -0.537 . . . . 0.0 112.161 -178.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.808 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -66.5 -18.54 65.42 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.103 0.478 . . . . 0.0 110.246 -179.762 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.771 ' HA ' HG21 ' A' ' 470' ' ' THR . 4.1 pt-20 -63.4 -30.87 71.92 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.597 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.737 ' OE1' HG23 ' B' ' 600' ' ' VAL . 0.5 OUTLIER -78.1 -47.97 17.08 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.126 -179.115 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.615 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.1 pp -52.33 -26.59 9.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.214 0.531 . . . . 0.0 110.89 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.913 HD22 ' HG ' ' A' ' 497' ' ' LEU . 13.1 tp -69.61 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.483 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.772 HG22 ' HG ' ' B' ' 597' ' ' LEU . 34.4 m -143.75 30.56 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.65 -178.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.463 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 54.6 mtp180 -137.23 38.96 2.51 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.221 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . 0.737 HG23 ' OE1' ' B' ' 595' ' ' GLU . 10.5 p . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.316 -0.85 . . . . 0.0 111.089 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 2.6 p30 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.861 0.363 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.912 HG13 ' CG2' ' A' ' 482' ' ' THR . 7.5 p -60.86 159.69 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.077 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.511 ' N ' HG22 ' A' ' 452' ' ' VAL . 0.0 OUTLIER -156.24 131.97 9.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.85 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.865 HG22 ' CD2' ' A' ' 477' ' ' PHE . 79.0 t -68.25 108.63 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.555 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.603 ' O ' HG23 ' A' ' 459' ' ' VAL . 23.4 p -131.52 157.78 42.66 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 121.556 0.693 . . . . 0.0 112.481 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.822 ' HA ' HG23 ' A' ' 496' ' ' ILE . 22.9 mt-10 -51.38 -53.36 37.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.475 -1.239 . . . . 0.0 110.941 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.71 -31.46 72.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.23 -0.896 . . . . 0.0 112.56 -179.151 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.437 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -71.37 -36.69 71.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.396 -179.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.798 ' HB ' HD21 ' A' ' 500' ' ' LEU . 16.4 t -72.31 -25.7 23.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 120.634 -0.426 . . . . 0.0 111.121 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.2 OUTLIER -63.11 -51.04 68.12 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.109 0.48 . . . . 0.0 109.814 178.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.485 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -54.93 -28.09 48.28 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 179.394 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.505 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 12.9 m-30 -68.81 -45.31 71.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.148 179.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.808 HD11 HD22 ' A' ' 500' ' ' LEU . 0.7 OUTLIER -68.47 -57.4 5.88 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.238 179.704 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.71 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.84 -24.51 1.47 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.789 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.572 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 24.4 ttp180 -93.35 -31.33 14.7 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.531 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.572 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER 169.89 162.7 0.2 Allowed Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.662 -179.588 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.681 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 73.9 Cg_endo -72.0 163.31 39.2 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.341 2.027 . . . . 0.0 113.34 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.751 ' SD ' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -152.15 152.64 32.55 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.383 -178.794 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.714 HG23 ' CE1' ' A' ' 512' ' ' HIS . 0.6 OUTLIER -95.9 162.4 13.59 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 178.021 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.771 HG21 ' HA ' ' B' ' 594' ' ' GLU . 1.8 p -65.3 -34.11 77.57 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.18 -0.608 . . . . 0.0 110.853 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.846 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -73.63 -50.91 18.73 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.35 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -59.73 -19.68 51.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.228 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.764 HD13 HD11 ' A' ' 497' ' ' LEU . 0.4 OUTLIER -75.24 -41.25 57.91 Favored 'General case' 0 C--O 1.23 0.051 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.133 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 1.078 HD21 HD13 ' B' ' 590' ' ' LEU . 1.3 pp -84.33 -46.53 11.66 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -178.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 37.4 mmtt -46.69 -29.23 1.78 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.773 0.32 . . . . 0.0 111.479 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.488 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -78.06 -41.24 36.12 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.642 179.547 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.865 ' CD2' HG22 ' A' ' 454' ' ' VAL . 16.5 m-85 -69.86 -67.71 0.47 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.298 0.57 . . . . 0.0 110.073 179.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . 0.436 ' CG ' ' O ' ' A' ' 477' ' ' PHE . 7.0 pt20 47.72 174.43 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.089 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . 0.482 HG23 ' N ' ' A' ' 484' ' ' LEU . 0.2 OUTLIER -75.69 -1.55 25.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.534 -179.788 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 22.4 tptt -45.91 -29.62 1.46 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-O 120.608 0.242 . . . . 0.0 111.476 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.6 mmmt -149.21 -43.47 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.49 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.912 ' CG2' HG13 ' A' ' 452' ' ' VAL . 60.8 p -54.66 -17.2 3.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.051 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 63.82 18.27 61.69 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.19 -178.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.911 ' CD2' HG11 ' A' ' 492' ' ' VAL . 4.3 mp -108.13 122.16 46.32 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 120.961 0.41 . . . . 0.0 111.279 -179.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.26 156.72 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.729 179.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . 0.4 ' O ' HG23 ' A' ' 490' ' ' VAL . 1.0 OUTLIER -62.26 -24.13 67.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.09 178.861 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.405 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 10.7 mt-10 -88.84 -48.35 7.54 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.577 179.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.701 ' O ' HG12 ' A' ' 492' ' ' VAL . 3.1 mt-30 -60.42 -43.25 96.94 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.997 179.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 92.7 m -49.43 -29.36 6.33 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 121.111 0.481 . . . . 0.0 109.785 178.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 1.012 HG22 HD22 ' A' ' 474' ' ' LEU . 8.2 t -83.55 -40.97 16.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.3 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.937 178.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . 0.411 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 3.3 t30 -60.96 -29.78 69.86 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.278 -0.873 . . . . 0.0 109.98 178.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.911 HG11 ' CD2' ' A' ' 484' ' ' LEU . 6.8 p -99.03 -6.97 9.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.823 179.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.704 ' CD1' HD22 ' A' ' 497' ' ' LEU . 9.6 tp -94.88 -34.58 12.38 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.003 0.43 . . . . 0.0 110.483 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.538 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -61.29 -37.02 81.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.109 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.463 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.5 OUTLIER -66.45 -45.27 80.34 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.849 -179.483 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.822 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.9 mt -73.93 -40.15 52.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.79 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.913 ' HG ' HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -38.82 -63.04 0.55 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.891 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.645 ' HA ' HD12 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.5 -27.99 66.65 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.04 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -58.81 -21.06 55.44 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.083 0.468 . . . . 0.0 110.992 179.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.808 HD22 HD11 ' A' ' 463' ' ' LEU . 84.5 mt -61.67 -47.76 83.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.503 -179.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.59 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.9 t-20 60.95 57.67 3.59 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.04 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.59 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 58.5 Cg_endo -101.22 -160.63 0.04 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 124.291 3.327 . . . . 0.0 111.771 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.95 138.21 54.5 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.782 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.68 133.61 36.38 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.388 0.613 . . . . 0.0 111.719 -178.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -156.33 146.99 21.78 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.81 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.458 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 0.0 OUTLIER -89.22 111.26 22.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.94 0.4 . . . . 0.0 111.362 -179.818 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.53 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.78 110.93 22.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.172 179.299 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 1.5 t30 60.06 41.85 16.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.906 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . 0.458 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 3.9 t0 74.22 13.82 3.87 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.223 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 506' ' ' MET . 0.0 OUTLIER -116.08 130.64 56.9 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.838 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.675 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -60.51 108.7 0.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 0.0 110.718 -179.947 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.714 ' CE1' HG23 ' A' ' 469' ' ' THR . 19.4 m80 -122.58 155.75 35.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.673 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.746 ' CD1' HD21 ' B' ' 597' ' ' LEU . 5.3 p90 -134.29 123.69 24.62 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.757 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.681 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER 179.77 169.43 1.16 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.391 0.615 . . . . 0.0 112.03 -178.99 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.811 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -118.54 168.86 10.28 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.425 178.454 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.406 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -135.07 106.02 6.61 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.167 0.508 . . . . 0.0 111.165 179.369 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.71 ' HG2' HG22 ' A' ' 464' ' ' THR . 1.8 pt-20 . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.023 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.813 0.34 . . . . 0.0 111.206 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -60.36 91.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.892 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.839 ' O2P' HG22 ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . 0.409 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 17.0 t70 -90.07 49.36 1.7 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 121.015 0.436 . . . . 0.0 110.73 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.464 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 0.0 OUTLIER -86.41 -37.62 18.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.984 179.52 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.09 -22.87 31.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.784 -179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -52.72 -55.16 24.72 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.091 0.472 . . . . 0.0 111.56 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.464 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.0 OUTLIER -79.7 -21.89 44.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.181 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.87 ' CD1' HD21 ' A' ' 474' ' ' LEU . 28.2 tp -52.0 -39.81 60.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.043 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 54.5 mt -86.06 -29.71 6.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.134 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.559 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.57 -39.61 84.9 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.45 -179.781 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.804 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.52 -18.0 55.38 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.156 0.503 . . . . 0.0 109.92 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.75 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.4 OUTLIER -63.43 -30.76 71.84 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.974 179.709 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.65 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 6.5 pt-20 -80.73 -47.41 14.0 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.721 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.5 pp -50.15 -26.54 3.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.138 0.494 . . . . 0.0 110.991 179.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.972 HD13 ' HB3' ' A' ' 497' ' ' LEU . 11.9 tp -64.63 -83.77 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.307 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.74 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.8 m -136.09 31.2 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.147 0 CA-C-N 114.832 -1.076 . . . . 0.0 111.188 -177.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.65 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 1.7 mtp-105 -136.8 108.14 6.86 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.161 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.2 p . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.135 179.994 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 6.8 p30 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.876 0.369 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.771 ' O ' HG22 ' A' ' 482' ' ' THR . 16.3 m -155.38 -166.41 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.947 179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -137.11 132.9 34.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.821 0.344 . . . . 0.0 110.653 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.525 HG22 ' CE2' ' A' ' 477' ' ' PHE . 7.5 t -77.87 104.71 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.636 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.504 ' O ' HG23 ' A' ' 459' ' ' VAL . 23.2 p -132.02 164.29 26.52 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.539 0.685 . . . . 0.0 112.192 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.701 ' HA ' HG23 ' A' ' 496' ' ' ILE . 18.6 mt-10 -57.33 -53.47 57.79 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.506 179.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.99 -29.22 63.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.07 -179.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.406 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -74.6 -35.06 62.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.644 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.754 ' CG1' HD21 ' A' ' 500' ' ' LEU . 14.2 t -76.02 -28.36 18.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 C-N-CA 120.859 -0.337 . . . . 0.0 111.511 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.4 OUTLIER -62.73 -50.82 69.57 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 178.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.46 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.1 OUTLIER -55.43 -27.04 45.46 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.356 179.053 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.507 ' O ' ' O ' ' A' ' 466' ' ' LYS . 11.4 m-30 -68.38 -44.44 75.14 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.084 HD11 HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -70.58 -54.36 12.36 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.099 179.318 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.448 HG22 ' CG ' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.09 -24.65 1.17 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.673 179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.606 ' O ' ' HG2' ' A' ' 466' ' ' LYS . 3.5 ptp85 -97.04 -47.84 5.63 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.336 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.689 ' HD3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -165.77 166.79 9.64 Favored Pre-proline 0 CA--C 1.533 0.31 0 C-N-CA 122.316 0.247 . . . . 0.0 110.708 179.905 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.689 ' HD2' ' HD3' ' A' ' 466' ' ' LYS . 97.0 Cg_endo -77.15 162.86 31.17 Favored 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.276 1.984 . . . . 0.0 113.551 -179.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.706 ' SD ' HD11 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -156.14 151.16 26.35 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.168 -178.74 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.673 HG22 ' O ' ' A' ' 511' ' ' MET . 10.9 p -99.11 175.06 6.03 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.506 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.6 OUTLIER -71.31 -31.52 67.53 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.455 -0.498 . . . . 0.0 111.333 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.85 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -77.0 -53.52 7.72 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.325 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -57.89 -19.94 33.2 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.757 178.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.883 HD12 HD11 ' A' ' 497' ' ' LEU . 6.8 mt -77.27 -40.92 42.94 Favored 'General case' 0 C--O 1.23 0.054 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.895 HD22 HG22 ' A' ' 490' ' ' VAL . 1.6 pp -84.22 -47.37 10.88 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -178.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.562 ' N ' HD12 ' A' ' 474' ' ' LEU . 18.0 mmtp -46.85 -28.33 1.53 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.698 0.285 . . . . 0.0 111.484 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.52 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -79.56 -41.03 28.11 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.653 179.545 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.525 ' CE2' HG22 ' A' ' 454' ' ' VAL . 16.8 m-85 -69.9 -67.31 0.5 Allowed 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 121.529 0.681 . . . . 0.0 110.053 179.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 53.4 173.93 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.712 -1.131 . . . . 0.0 111.507 179.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 11.5 t -75.06 -21.14 59.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.133 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -17.12 34.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.438 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -113.68 -75.59 0.6 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.78 0.324 . . . . 0.0 111.836 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.771 HG22 ' O ' ' A' ' 452' ' ' VAL . 30.2 p -74.07 9.4 1.6 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.758 -179.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 58.41 19.78 42.1 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.788 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.906 HD23 HG11 ' A' ' 492' ' ' VAL . 1.5 mp -105.46 122.88 46.9 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 120.919 0.39 . . . . 0.0 111.422 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -42.93 154.23 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.82 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . 0.533 ' O ' HG23 ' A' ' 490' ' ' VAL . 74.2 m -61.15 -26.41 67.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.139 179.002 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -84.61 -53.28 5.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.443 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.581 ' O ' HG12 ' A' ' 492' ' ' VAL . 0.9 OUTLIER -59.66 -40.48 87.86 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.023 179.392 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 44.2 m -51.43 -31.06 21.62 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.895 HG22 HD22 ' A' ' 474' ' ' LEU . 2.5 t -78.86 -42.59 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.309 179.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.51 -34.05 72.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.897 179.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.906 HG11 HD23 ' A' ' 484' ' ' LEU . 7.3 p -93.7 -10.46 9.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.75 179.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.588 ' HG ' HD23 ' A' ' 497' ' ' LEU . 21.2 tp -90.24 -44.39 9.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.092 0.473 . . . . 0.0 110.554 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.716 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -51.61 -33.9 35.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.69 -179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.74 -41.9 78.34 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.174 -0.466 . . . . 0.0 112.216 -179.093 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.701 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.5 mt -79.13 -29.95 14.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -178.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.972 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.3 OUTLIER -47.63 -58.35 4.38 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.489 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.721 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.42 -28.05 66.59 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -177.856 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.556 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.5 mmm180 -60.38 -20.84 61.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.057 0.456 . . . . 0.0 110.19 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.084 HD22 HD11 ' A' ' 463' ' ' LEU . 77.4 mt -59.59 -47.61 84.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.037 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.634 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 28.0 t-20 55.36 54.5 9.71 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.164 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.634 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 69.7 Cg_endo -101.25 -160.15 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.248 0 C-N-CA 124.071 3.181 . . . . 0.0 111.596 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -119.19 140.44 50.19 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.075 -0.512 . . . . 0.0 109.834 178.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.7 133.57 36.37 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.316 0.579 . . . . 0.0 111.477 -178.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 24.9 mtmt -156.36 132.11 9.63 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.989 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.18 108.86 13.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.876 0.369 . . . . 0.0 111.396 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.469 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.61 110.8 22.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.938 179.047 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 66.2 t30 59.64 43.9 15.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.857 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.6 t0 72.4 13.29 5.54 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.279 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.416 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.08 128.44 55.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.777 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.673 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -60.98 108.65 0.9 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.041 0.448 . . . . 0.0 110.519 179.838 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.547 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 24.7 m80 -122.8 132.82 54.39 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.211 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.639 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.0 OUTLIER -108.51 123.77 49.41 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.788 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.583 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER -171.82 169.69 5.74 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.556 0.693 . . . . 0.0 112.762 -178.735 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.817 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -129.19 168.92 15.46 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.646 -1.161 . . . . 0.0 109.341 178.401 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.44 105.78 7.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.064 0.459 . . . . 0.0 110.9 179.106 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.448 ' CG ' HG22 ' A' ' 464' ' ' THR . 39.3 mm-40 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.251 -0.88 . . . . 0.0 110.918 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.886 0.374 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -60.34 87.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.904 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.575 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -90.12 49.78 1.76 Allowed 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.019 0.438 . . . . 0.0 110.721 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.455 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.0 pt-20 -86.12 -35.2 20.33 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.816 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . 0.53 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.6 OUTLIER -84.06 -22.78 31.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.566 -179.351 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -53.45 -55.16 27.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.077 0.465 . . . . 0.0 111.561 -179.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.455 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 0.9 OUTLIER -80.01 -21.81 43.16 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.235 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 1.021 ' CD1' HD21 ' A' ' 474' ' ' LEU . 39.1 tp -48.63 -29.54 4.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.299 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . 0.527 HG23 ' OE1' ' B' ' 594' ' ' GLU . 79.1 mt -85.61 -29.77 6.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.216 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.574 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.48 -52.13 65.77 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.15 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.806 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -66.51 -17.94 65.09 Favored 'General case' 0 C--N 1.316 -0.874 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.497 -179.612 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.527 ' OE1' HG23 ' B' ' 591' ' ' ILE . 1.0 OUTLIER -62.28 -30.87 71.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.968 -179.682 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.502 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 1.6 pt-20 -82.52 -43.73 16.79 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -179.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.591 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -53.86 -26.5 14.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-O 121.097 0.475 . . . . 0.0 111.172 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.909 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.6 tp -71.1 -82.65 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.557 0.694 . . . . 0.0 112.041 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.669 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.4 m -140.5 29.87 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.627 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.502 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 25.4 mtp180 -141.7 40.83 1.7 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.181 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 9.7 p . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.272 -0.87 . . . . 0.0 111.07 -179.992 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 33.1 p-10 . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.84 0.352 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.567 ' C ' HG22 ' A' ' 482' ' ' THR . 14.0 p -167.14 160.66 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.095 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.499 ' N ' HG22 ' A' ' 452' ' ' VAL . 4.0 mt-30 -41.72 131.4 3.15 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.877 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.789 HG22 ' CD2' ' A' ' 477' ' ' PHE . 59.3 t -90.42 116.89 32.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.648 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.446 ' O ' HG23 ' A' ' 459' ' ' VAL . 25.4 p -131.65 163.36 28.28 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 121.642 0.734 . . . . 0.0 112.503 -179.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.787 ' HA ' HG23 ' A' ' 496' ' ' ILE . 22.3 mt-10 -58.56 -52.57 65.1 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.51 -1.223 . . . . 0.0 110.933 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.03 -27.49 68.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.581 -178.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.474 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -70.07 -58.18 4.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.738 0.304 . . . . 0.0 111.62 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.918 ' HB ' HD21 ' A' ' 500' ' ' LEU . 16.9 t -48.17 -31.72 3.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.946 0.403 . . . . 0.0 110.9 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.572 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -54.69 -47.99 72.98 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 178.259 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -63.35 -27.88 69.62 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.507 179.452 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.512 ' CE2' ' CE2' ' A' ' 477' ' ' PHE . 8.2 m-30 -68.78 -42.9 76.76 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.289 0.566 . . . . 0.0 109.649 178.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.089 HD11 HD13 ' A' ' 500' ' ' LEU . 3.7 mt -70.35 -60.29 2.36 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.964 -179.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.661 HG22 ' HG2' ' A' ' 517' ' ' GLU . 0.1 OUTLIER -49.44 -24.43 1.99 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.065 -179.569 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 4.6 mtt-85 -92.93 -46.04 7.67 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.508 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.489 ' HD2' ' HD2' ' A' ' 467' ' ' PRO . 1.4 mmmt -165.2 128.8 1.67 Allowed Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.005 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.564 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 18.0 Cg_endo -56.17 146.09 72.85 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.358 2.039 . . . . 0.0 112.716 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.629 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -132.78 178.23 7.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.278 -179.276 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.571 HG22 ' O ' ' A' ' 511' ' ' MET . 10.1 p -124.16 160.71 27.24 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.094 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.586 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.7 OUTLIER -58.22 -30.84 66.82 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.192 -0.603 . . . . 0.0 111.251 -179.174 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 1.012 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -76.53 -50.84 12.93 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.823 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . 0.432 ' HA ' ' CD ' ' A' ' 475' ' ' LYS . 11.9 t70 -64.79 -31.04 72.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.86 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.767 HD13 HD11 ' A' ' 493' ' ' LEU . 0.5 OUTLIER -60.13 -42.36 94.62 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 121.164 0.507 . . . . 0.0 110.985 -179.558 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 1.021 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.9 pp -85.24 -25.03 27.53 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.555 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.477 ' HD2' ' O ' ' A' ' 471' ' ' LYS . 4.1 mttt -46.05 -36.32 5.62 Favored 'General case' 0 N--CA 1.461 0.109 0 N-CA-C 111.628 0.232 . . . . 0.0 111.628 -178.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.527 ' HE3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -93.43 -43.23 8.85 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.135 179.573 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.789 ' CD2' HG22 ' A' ' 454' ' ' VAL . 3.0 m-85 -59.35 -30.42 68.38 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 121.381 0.61 . . . . 0.0 110.158 179.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 475' ' ' LYS . 0.0 OUTLIER -72.17 113.79 9.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.908 -179.81 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 97.8 m -164.89 -76.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.891 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp 177.6 -34.15 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.177 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.75 -47.15 59.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.459 -179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.567 HG22 ' C ' ' A' ' 452' ' ' VAL . 75.9 p -60.66 -11.96 8.89 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.004 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 58.3 21.89 49.01 Favored Glycine 0 C--N 1.336 0.562 0 C-N-CA 120.337 -0.935 . . . . 0.0 110.827 -178.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 1.004 HD23 HG11 ' A' ' 492' ' ' VAL . 0.2 OUTLIER -114.87 119.62 37.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 115.191 -0.505 . . . . 0.0 111.407 -179.054 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -44.51 161.09 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.496 179.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 98.9 p -60.89 -24.98 66.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.021 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -91.02 -43.51 9.89 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.349 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.663 ' O ' HG12 ' A' ' 492' ' ' VAL . 2.0 mt-30 -64.08 -41.24 97.39 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.628 -0.714 . . . . 0.0 109.918 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . . . . . . . . . 91.8 m -51.75 -27.7 12.9 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.714 178.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.783 HG22 HD22 ' A' ' 474' ' ' LEU . 6.6 t -84.94 -40.37 14.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.813 178.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -61.09 -32.0 71.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.911 178.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 1.004 HG11 HD23 ' A' ' 484' ' ' LEU . 7.7 p -94.01 -11.15 9.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.752 179.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.767 HD11 HD13 ' A' ' 473' ' ' LEU . 21.8 tp -89.85 -43.04 10.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.216 0.531 . . . . 0.0 110.204 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.573 ' HB2' ' HB2' ' B' ' 593' ' ' LEU . . . -51.97 -33.54 38.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.658 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.511 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -68.23 -42.88 79.11 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.891 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.787 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.9 mt -72.86 -45.28 56.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -178.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.909 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.7 OUTLIER -37.38 -64.01 0.4 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.6 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.591 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.61 -27.06 65.97 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.991 0.424 . . . . 0.0 111.261 -179.282 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.71 -26.5 68.7 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.547 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.089 HD13 HD11 ' A' ' 463' ' ' LEU . 67.3 mt -60.36 -47.37 86.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.918 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.56 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 59.12 59.69 5.13 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.732 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.56 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 91.7 Cg_endo -101.19 -159.25 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.326 0 C-N-CA 124.04 3.16 . . . . 0.0 111.317 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.39 141.53 48.45 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.738 178.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 24.2 ptt180 -79.47 134.23 36.53 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.321 0.581 . . . . 0.0 111.292 -179.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -156.12 157.95 36.87 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.857 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.441 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.8 OUTLIER -105.19 109.94 22.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.93 0.395 . . . . 0.0 111.532 -179.757 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.488 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.72 110.79 22.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.867 178.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 59.51 44.41 14.82 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.739 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 6.5 t0 71.16 13.83 6.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.257 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.45 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.8 tpmt? -116.15 134.69 54.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.784 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.571 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -65.78 108.74 2.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.937 0.399 . . . . 0.0 110.88 -179.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.508 ' CE1' ' CG2' ' A' ' 469' ' ' THR . 25.6 m80 -123.05 130.7 53.13 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.093 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.63 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -105.0 125.44 50.98 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.092 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.564 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.2 OUTLIER -175.29 169.33 3.25 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -178.78 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.703 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.2 pt? -122.74 169.14 11.38 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.062 178.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.79 106.75 8.31 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.434 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.661 ' HG2' HG22 ' A' ' 464' ' ' THR . 6.1 pt-20 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.259 -0.877 . . . . 0.0 111.044 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.844 0.354 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -60.69 86.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.926 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.585 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -90.2 49.13 1.65 Allowed 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 121.022 0.439 . . . . 0.0 110.598 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.562 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.2 pt-20 -86.52 -47.31 9.36 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.357 179.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . 0.412 ' O ' ' HB3' ' B' ' 590' ' ' LEU . 1.1 p30 -53.53 -22.46 8.27 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.554 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -57.51 -40.8 79.52 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.899 0.381 . . . . 0.0 111.413 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.562 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 2.1 p-80 -80.32 -21.87 42.09 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.724 -179.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.938 ' CD1' HD21 ' A' ' 474' ' ' LEU . 16.6 tp -53.5 -31.05 44.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.957 0.408 . . . . 0.0 110.72 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 70.7 mt -85.76 -29.59 6.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.892 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.578 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.42 -38.74 92.1 Favored 'General case' 0 N--CA 1.461 0.103 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.809 -179.441 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.824 HD13 ' N ' ' B' ' 594' ' ' GLU . 0.0 OUTLIER -78.39 -18.0 55.65 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.191 0.52 . . . . 0.0 109.988 -179.887 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.824 ' N ' HD13 ' B' ' 593' ' ' LEU . 1.1 pt-20 -62.37 -30.75 71.41 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.844 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.585 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 7.5 pt-20 -82.2 -48.49 11.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.316 -179.101 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.734 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -52.39 -26.8 9.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.22 0.533 . . . . 0.0 111.211 179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.994 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.8 tp -60.87 -84.86 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.343 -0.844 . . . . 0.0 113.027 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.739 HG13 ' HG ' ' B' ' 597' ' ' LEU . 34.8 m -131.74 39.85 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.156 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.679 -177.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.585 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 39.6 mtp180 -129.45 100.34 5.52 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.2 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.072 179.99 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.407 0 CA-C-O 120.86 0.362 . . . . 0.0 111.226 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.817 HG13 ' CG2' ' A' ' 482' ' ' THR . 7.6 p -169.51 160.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.045 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.519 ' N ' HG22 ' A' ' 452' ' ' VAL . 0.9 OUTLIER -156.1 132.26 9.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.896 -179.891 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.866 HG22 ' CD2' ' A' ' 477' ' ' PHE . 93.1 t -66.45 111.85 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.349 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.564 179.713 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.473 ' O ' HG23 ' A' ' 459' ' ' VAL . 23.6 p -131.49 163.66 27.48 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.634 0.73 . . . . 0.0 112.361 -179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.809 ' HA ' HG23 ' A' ' 496' ' ' ILE . 21.7 mt-10 -57.99 -53.08 62.31 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.55 -1.204 . . . . 0.0 110.67 179.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.49 -28.09 68.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.103 -0.953 . . . . 0.0 112.0 -179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.414 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -67.51 -58.07 5.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.828 0.346 . . . . 0.0 111.36 -179.606 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.86 ' HB ' HD21 ' A' ' 500' ' ' LEU . 21.2 t -50.58 -28.83 6.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.581 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.508 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.9 OUTLIER -58.5 -45.49 88.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.978 0.418 . . . . 0.0 110.434 179.036 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.439 ' HG2' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -60.87 -25.38 66.64 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.929 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.525 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 8.8 m-30 -77.83 -39.74 42.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.832 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.827 HD11 HD22 ' A' ' 500' ' ' LEU . 0.9 OUTLIER -70.08 -61.4 1.79 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.233 179.914 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.751 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.1 OUTLIER -48.37 -27.27 2.48 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.093 0.473 . . . . 0.0 110.563 179.783 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 45.1 ttp180 -87.1 -50.32 6.71 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.907 179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.419 ' HD2' ' HD2' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -167.46 128.28 1.18 Allowed Pre-proline 0 CA--C 1.53 0.194 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.612 -179.839 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.621 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 9.0 Cg_endo -48.78 169.7 0.09 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.234 1.956 . . . . 0.0 112.502 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.523 ' SD ' HD22 ' A' ' 463' ' ' LEU . 0.0 OUTLIER -156.42 -178.55 7.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.601 0.715 . . . . 0.0 111.88 -178.801 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.818 HG23 ' ND1' ' A' ' 512' ' ' HIS . 0.2 OUTLIER -119.84 170.61 9.08 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.59 -1.186 . . . . 0.0 107.818 177.744 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.509 HG23 HD22 ' B' ' 597' ' ' LEU . 0.6 OUTLIER -71.15 -32.86 69.47 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 120.074 -0.65 . . . . 0.0 110.612 179.682 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.785 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -76.86 -46.66 23.79 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.461 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -64.25 -20.53 66.12 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.534 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.758 HD12 HD11 ' A' ' 497' ' ' LEU . 4.8 mt -78.39 -37.23 44.53 Favored 'General case' 0 C--N 1.334 -0.081 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.998 HD22 HG22 ' A' ' 490' ' ' VAL . 1.4 pp -82.46 -49.51 9.86 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.264 0.468 . . . . 0.0 112.264 -179.132 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.616 ' N ' HD12 ' A' ' 474' ' ' LEU . 16.1 mmtp -46.72 -28.84 1.64 Allowed 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.479 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -75.76 -43.0 48.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.921 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.866 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.5 m-85 -66.79 -65.56 0.66 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.475 0.655 . . . . 0.0 110.294 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 13.8 mt-30 53.6 174.22 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.918 -1.037 . . . . 0.0 111.455 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . 0.484 HG23 ' N ' ' A' ' 484' ' ' LEU . 0.6 OUTLIER -79.48 3.03 19.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.545 179.923 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -45.74 -39.8 8.61 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.697 0.284 . . . . 0.0 111.533 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . 0.633 ' HB2' HG12 ' A' ' 452' ' ' VAL . 8.7 mmtt -141.09 -43.15 0.38 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.493 -180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.817 ' CG2' HG13 ' A' ' 452' ' ' VAL . 60.2 p -53.77 -17.64 2.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.221 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.431 ' C ' HG23 ' A' ' 479' ' ' THR . . . 65.99 19.22 67.59 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.432 -0.889 . . . . 0.0 111.479 -179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 1.005 HD23 HG11 ' A' ' 492' ' ' VAL . 0.2 OUTLIER -108.49 120.62 42.96 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.953 0.406 . . . . 0.0 111.096 -179.573 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.12 160.82 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.532 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . 0.412 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.2 OUTLIER -59.85 -23.93 63.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.162 0.506 . . . . 0.0 109.741 178.558 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.411 ' HG3' ' CE1' ' B' ' 589' ' ' HIS . 10.5 tt0 -89.77 -51.4 5.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.167 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.721 ' O ' HG12 ' A' ' 492' ' ' VAL . 0.8 OUTLIER -59.06 -41.68 88.51 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.019 179.386 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.454 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 91.9 m -50.61 -30.5 13.5 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.715 178.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.998 HG22 HD22 ' A' ' 474' ' ' LEU . 3.4 t -82.57 -40.59 16.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.184 179.211 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -60.37 -30.74 69.76 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.962 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 1.005 HG11 HD23 ' A' ' 484' ' ' LEU . 5.6 p -99.01 -6.94 9.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.835 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.781 HD11 HD22 ' A' ' 497' ' ' LEU . 13.8 tp -94.29 -40.79 9.79 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.032 0.444 . . . . 0.0 110.557 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.693 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -54.67 -38.02 66.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.442 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.489 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.59 -41.92 95.92 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.935 -179.286 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.809 HG23 ' HA ' ' A' ' 456' ' ' GLU . 13.7 mt -77.75 -48.17 24.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.994 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -31.58 -64.05 0.16 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.487 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.734 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -60.18 -29.82 68.95 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -178.415 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . . . . . . . . . 2.9 tpt180 -55.52 -23.3 25.57 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.971 0.415 . . . . 0.0 111.036 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.86 HD21 ' HB ' ' A' ' 459' ' ' VAL . 16.0 mt -63.1 -47.45 82.79 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.654 -179.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.558 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 25.3 t-20 60.68 59.83 3.65 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.013 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.558 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 53.1 Cg_endo -99.78 -159.24 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 123.983 3.122 . . . . 0.0 111.6 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.55 140.19 51.83 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.828 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.59 134.89 36.48 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.369 0.604 . . . . 0.0 111.713 -178.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.6 mtmt -156.22 160.08 39.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.588 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.56 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 8.6 ptm -97.79 109.95 22.61 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.137 0.494 . . . . 0.0 111.589 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.552 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.3 OUTLIER -90.63 110.92 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.852 179.103 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 60.37 38.77 19.33 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.719 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . 0.56 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 5.2 t70 77.86 10.15 2.21 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.573 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.447 ' HA ' ' HE2' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -116.24 134.23 55.14 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.619 0.247 . . . . 0.0 111.088 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.459 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.04 108.61 1.26 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.098 0.475 . . . . 0.0 111.004 -179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.818 ' ND1' HG23 ' A' ' 469' ' ' THR . 2.2 m80 -122.62 148.37 45.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.436 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.628 ' CZ ' HD23 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -126.1 123.31 38.06 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.245 179.666 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.769 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.3 OUTLIER -176.68 169.3 2.54 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.142 0.496 . . . . 0.0 111.945 -179.129 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.765 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.6 pt? -114.24 169.15 9.24 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.404 178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.419 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -142.35 106.43 4.74 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.029 0.443 . . . . 0.0 111.378 179.683 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.751 ' HB2' HG22 ' A' ' 464' ' ' THR . 28.6 mm-40 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.826 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.768 0.318 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -63.13 82.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.935 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.61 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -90.23 49.13 1.65 Allowed 'General case' 0 N--CA 1.45 -0.455 0 CA-C-O 120.992 0.425 . . . . 0.0 110.651 179.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.536 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 3.0 pp20? -86.45 -45.39 11.19 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.421 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -53.73 -22.76 9.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.539 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -51.87 -47.28 64.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.962 0.411 . . . . 0.0 111.376 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.536 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 2.1 p-80 -80.07 -21.85 42.93 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.238 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.907 ' CD1' HD21 ' A' ' 474' ' ' LEU . 26.1 tp -62.95 -43.61 98.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.793 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . 0.408 ' O ' ' HB3' ' B' ' 594' ' ' GLU . 51.3 mt -86.13 -29.55 6.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 120.813 0.34 . . . . 0.0 111.009 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.567 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -63.28 -44.97 93.55 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.643 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 1.039 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -69.69 -19.72 63.57 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.38 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.721 ' N ' HD13 ' B' ' 593' ' ' LEU . 10.6 tt0 -63.13 -30.86 71.93 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.337 179.298 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.425 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.3 OUTLIER -72.32 -44.45 62.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.495 -179.492 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 1.05 HD11 ' HB1' ' A' ' 494' ' ' ALA . 4.8 pt -58.17 -26.64 30.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.184 0.516 . . . . 0.0 110.963 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.825 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.0 tp -72.73 -81.78 0.05 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.04 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.708 HG22 ' HG ' ' B' ' 597' ' ' LEU . 33.0 m -141.14 30.28 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.054 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.731 -177.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.425 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 7.9 mtp180 -138.93 38.8 2.16 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.368 -179.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 30.2 m . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.111 -179.956 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.741 0.305 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.815 ' HB ' HG22 ' A' ' 482' ' ' THR . 21.8 t -61.88 144.13 14.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.099 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.13 133.4 44.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.775 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.468 HG22 ' CE2' ' A' ' 477' ' ' PHE . 0.9 OUTLIER -84.33 114.88 25.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.796 179.903 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.559 ' O ' HG23 ' A' ' 459' ' ' VAL . 27.4 p -131.65 169.87 15.55 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.557 0.694 . . . . 0.0 112.654 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.596 ' HA ' HG23 ' A' ' 496' ' ' ILE . 20.6 mt-10 -69.13 -54.7 13.59 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.271 179.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.96 -26.76 6.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.758 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.431 ' O ' ' CD1' ' A' ' 462' ' ' TYR . . . -77.16 -35.54 55.89 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.85 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.779 HG13 HD11 ' A' ' 473' ' ' LEU . 4.0 t -76.1 -40.15 36.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.876 0.37 . . . . 0.0 111.392 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.571 ' CD ' HD23 ' A' ' 500' ' ' LEU . 1.6 mmm180 -53.99 -39.24 65.88 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.254 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.449 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -70.8 -28.83 64.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.614 179.334 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.449 ' N ' ' HG3' ' A' ' 461' ' ' ARG . 14.2 m-30 -65.69 -36.95 85.1 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.084 HD11 HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -74.27 -55.96 5.44 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.838 179.718 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.815 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -50.48 -25.36 3.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.679 179.867 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 466' ' ' LYS . 24.6 ptt180 -92.99 -39.45 11.1 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.223 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.423 ' O ' ' O ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -176.73 132.24 0.38 Allowed Pre-proline 0 CA--C 1.535 0.379 0 CA-C-O 120.72 0.295 . . . . 0.0 111.044 179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.585 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 18.0 Cg_endo -58.06 152.47 51.48 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.752 2.301 . . . . 0.0 113.41 -179.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.843 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.09 161.36 42.51 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.507 -179.505 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.765 HG22 ' O ' ' A' ' 511' ' ' MET . 11.6 p -96.62 -178.41 4.25 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 176.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 1.039 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -71.06 -44.71 65.2 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 119.687 -0.805 . . . . 0.0 110.88 179.593 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.823 ' HB3' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -62.32 -51.88 65.88 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.995 179.284 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . 0.413 ' H ' ' HG2' ' A' ' 471' ' ' LYS . 36.4 t70 -57.85 -26.71 62.43 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.388 179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.843 HD12 ' CG ' ' A' ' 468' ' ' MET . 1.0 OUTLIER -83.05 -41.52 18.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.104 0.478 . . . . 0.0 111.37 -179.654 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.975 ' HB3' HD23 ' A' ' 493' ' ' LEU . 2.6 pp -83.98 -25.94 29.62 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -178.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.491 ' HD2' ' HB2' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -48.24 -33.59 8.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.685 0.279 . . . . 0.0 111.607 -178.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.482 ' HE2' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -87.5 -43.11 12.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.41 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.482 ' CD2' ' HE2' ' A' ' 476' ' ' LYS . 3.8 m-85 -61.15 -12.46 12.65 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 111.744 0.275 . . . . 0.0 111.744 179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.44 174.09 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.11 0.481 . . . . 0.0 111.738 -179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . 0.431 HG23 ' C ' ' A' ' 483' ' ' GLY . 1.1 m -53.12 -17.27 1.49 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.88 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -37.6 -32.93 0.06 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 112.141 0.422 . . . . 0.0 112.141 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.2 -55.0 0.31 Allowed 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.815 HG22 ' HB ' ' A' ' 452' ' ' VAL . 17.0 p -56.78 -12.82 2.09 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.35 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.431 ' C ' HG23 ' A' ' 479' ' ' THR . . . 68.62 17.68 71.2 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.514 -0.85 . . . . 0.0 111.587 -179.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.401 ' HB3' ' OG1' ' A' ' 489' ' ' THR . 0.4 OUTLIER -104.57 123.21 47.13 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 120.857 0.361 . . . . 0.0 111.058 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.42 150.83 0.06 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.916 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . 0.479 ' O ' HG23 ' A' ' 490' ' ' VAL . 6.3 t -61.43 -23.09 65.59 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.373 179.233 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.425 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 7.9 mt-10 -90.94 -48.44 7.0 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.598 179.714 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.56 -45.18 94.86 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.257 179.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.421 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 91.1 m -49.56 -35.37 20.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.132 179.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.694 HG13 HD22 ' A' ' 474' ' ' LEU . 2.2 t -75.75 -44.1 39.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.078 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.15 -26.2 49.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.417 -0.81 . . . . 0.0 110.082 179.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.46 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 8.7 p -102.17 -15.29 7.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.085 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.975 HD23 ' HB3' ' A' ' 474' ' ' LEU . 1.8 tp -89.04 -42.52 11.7 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.106 0.479 . . . . 0.0 110.823 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 1.05 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -51.29 -37.12 45.68 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.604 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.46 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -64.33 -37.88 89.06 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.668 -179.506 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.596 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.0 mt -78.73 -42.52 25.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.825 ' HB3' HD13 ' B' ' 597' ' ' LEU . 3.2 mm? -41.83 -50.4 4.39 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.832 ' NZ ' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -61.18 -25.62 67.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.834 0.349 . . . . 0.0 111.593 -179.157 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.484 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 9.1 mmp_? -64.16 -19.04 65.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.969 0.414 . . . . 0.0 110.478 179.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.084 HD22 HD11 ' A' ' 463' ' ' LEU . 64.8 mt -62.13 -47.48 84.4 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.839 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.614 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.3 t-20 54.66 57.08 11.95 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.334 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.614 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 83.1 Cg_endo -102.24 -159.75 0.04 OUTLIER 'Trans proline' 0 N--CA 1.443 -1.454 0 C-N-CA 123.967 3.111 . . . . 0.0 111.672 -179.251 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.05 140.44 51.0 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.659 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . 0.447 ' HB2' ' HE1' ' A' ' 511' ' ' MET . 35.4 ptt85 -79.52 134.59 36.5 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.342 0.591 . . . . 0.0 111.435 -178.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt -156.02 160.26 39.86 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.757 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.492 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 8.3 ptm -103.72 110.23 22.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.941 0.4 . . . . 0.0 111.555 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.543 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.68 110.88 22.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.882 179.011 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 56.0 t30 59.7 40.52 19.75 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.685 -179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . 0.492 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 0.6 OUTLIER 75.7 12.54 3.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.373 -180.0 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.425 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.18 131.76 56.85 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.619 0.247 . . . . 0.0 111.003 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.765 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -61.67 108.7 1.03 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.057 0.456 . . . . 0.0 110.69 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.588 ' CE1' HG23 ' A' ' 469' ' ' THR . 9.1 m80 -122.6 131.4 53.81 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.701 -0.682 . . . . 0.0 111.063 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.659 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.1 OUTLIER -109.81 123.75 50.1 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.848 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.616 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.5 OUTLIER -179.23 169.11 1.5 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.22 0.533 . . . . 0.0 112.236 -178.858 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.705 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.4 pt? -119.33 169.23 10.18 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.44 179.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.423 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -139.26 106.3 5.45 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.987 0.422 . . . . 0.0 111.264 179.541 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.815 ' HB2' HG22 ' A' ' 464' ' ' THR . 4.4 mm-40 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.769 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.855 0.359 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -61.8 84.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.878 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.581 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . 0.408 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 12.4 p30 -85.26 49.62 1.79 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 120.855 0.36 . . . . 0.0 111.059 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.458 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 2.5 pp20? -85.9 -36.68 19.77 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.301 0.572 . . . . 0.0 110.514 179.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . 0.648 ' OD1' HD23 ' B' ' 590' ' ' LEU . 0.5 OUTLIER -84.25 -22.65 30.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.437 -0.802 . . . . 0.0 111.459 -179.572 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -53.8 -55.14 29.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.09 0.472 . . . . 0.0 111.367 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.458 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.1 p-80 -80.15 -21.88 42.62 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.224 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.911 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.7 tp -48.33 -33.79 9.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.128 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 68.4 mt -85.89 -29.65 6.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.86 0.362 . . . . 0.0 110.512 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.55 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -63.7 -40.38 96.65 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.15 179.906 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.811 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -80.16 -18.15 50.51 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.267 179.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.683 ' N ' HD13 ' B' ' 593' ' ' LEU . 71.0 tt0 -63.06 -30.91 71.97 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.863 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.507 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 9.6 pt-20 -80.63 -48.06 13.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.164 -179.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.677 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -52.2 -26.63 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.168 0.508 . . . . 0.0 110.893 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.923 HD22 ' HG ' ' A' ' 497' ' ' LEU . 13.4 tp -69.53 -82.65 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.936 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.684 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 30.8 m -140.47 29.27 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.436 -1.138 0 CA-C-N 114.57 -1.196 . . . . 0.0 110.319 -177.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.507 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.5 OUTLIER -143.25 39.24 1.43 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.241 -179.526 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.318 -0.848 . . . . 0.0 111.101 179.978 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.859 0.361 . . . . 0.0 111.277 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.768 ' O ' HG22 ' A' ' 482' ' ' THR . 7.3 p -62.83 124.99 18.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.111 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.97 134.14 43.31 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.744 179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.842 HG22 ' CE2' ' A' ' 477' ' ' PHE . 1.4 t -66.37 115.9 4.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.955 -179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.579 ' O ' HG23 ' A' ' 459' ' ' VAL . 33.1 p -131.56 169.12 16.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.609 0.718 . . . . 0.0 112.537 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.698 ' HA ' HG23 ' A' ' 496' ' ' ILE . 26.6 mt-10 -69.24 -53.49 19.6 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.591 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.66 -27.87 59.48 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.176 -0.92 . . . . 0.0 112.158 -179.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.43 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -73.98 -32.36 63.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.589 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.773 ' HB ' HD21 ' A' ' 500' ' ' LEU . 10.2 t -76.02 -36.72 32.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.864 0.364 . . . . 0.0 111.091 -179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.625 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -54.9 -46.05 74.8 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.123 179.106 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.441 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.2 OUTLIER -64.25 -26.15 68.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.793 179.486 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.532 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 18.0 m-30 -72.02 -36.31 69.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.141 179.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.862 HD11 HD22 ' A' ' 500' ' ' LEU . 1.3 mt -75.33 -59.39 2.77 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.186 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.538 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -46.11 -27.41 0.95 Allowed 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.555 179.827 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 27.7 ttt180 -85.77 -52.85 5.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.784 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.451 ' HG3' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -167.57 135.4 1.96 Allowed Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.575 -179.756 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.574 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 33.2 Cg_exo -53.74 176.69 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.014 1.809 . . . . 0.0 113.02 -179.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.99 ' HG2' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -164.73 171.76 13.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.878 -177.439 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.66 HG22 ' CD2' ' A' ' 512' ' ' HIS . 1.4 p -112.21 157.95 20.28 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 177.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.608 HG23 HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -59.17 -39.98 84.18 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.24 -0.584 . . . . 0.0 110.569 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.843 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -65.74 -50.91 63.07 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.765 178.942 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -62.9 -22.21 66.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.418 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.99 HD21 ' HG2' ' A' ' 468' ' ' MET . 10.7 mt -76.65 -46.26 26.56 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.911 HD21 ' CD1' ' B' ' 590' ' ' LEU . 0.5 OUTLIER -73.27 -50.7 20.82 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.761 0.315 . . . . 0.0 111.199 -179.169 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.664 ' HD3' HD12 ' A' ' 474' ' ' LEU . 23.8 mmtt -52.11 -25.19 8.21 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.185 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.632 ' HE2' ' CD2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -70.47 -43.99 68.64 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.853 0.358 . . . . 0.0 110.499 179.894 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.842 ' CE2' HG22 ' A' ' 454' ' ' VAL . 15.5 m-85 -69.95 -55.22 10.23 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-O 121.867 0.842 . . . . 0.0 109.874 179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 50.61 174.44 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.011 -1.45 . . . . 0.0 111.452 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . 0.431 HG23 ' N ' ' A' ' 484' ' ' LEU . 1.2 m -80.79 3.11 23.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.315 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 20.4 tptt -48.46 -44.07 35.18 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.574 0.226 . . . . 0.0 111.577 -179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.6 -45.94 0.89 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.648 0.261 . . . . 0.0 111.521 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.768 HG22 ' O ' ' A' ' 452' ' ' VAL . 13.9 p -53.92 -16.51 1.88 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.161 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 61.84 20.4 59.77 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.453 -0.88 . . . . 0.0 111.131 -179.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 1.066 HD23 HG11 ' A' ' 492' ' ' VAL . 0.3 OUTLIER -105.59 121.93 44.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 120.996 0.427 . . . . 0.0 111.366 -179.32 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.13 161.13 0.08 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.589 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 23.4 p -60.18 -25.15 65.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.077 0.465 . . . . 0.0 109.951 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -90.45 -46.3 8.43 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.422 179.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.665 ' O ' HG12 ' A' ' 492' ' ' VAL . 0.7 OUTLIER -62.21 -41.95 98.84 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.889 179.467 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 88.6 m -50.76 -29.31 11.15 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.547 HG13 HD22 ' A' ' 474' ' ' LEU . 3.2 t -83.93 -41.14 16.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.293 179.264 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.58 -28.21 65.34 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.321 179.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 1.066 HG11 HD23 ' A' ' 484' ' ' LEU . 4.4 p -101.58 -7.57 9.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.957 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.786 HD23 ' HB3' ' A' ' 474' ' ' LEU . 3.4 tp -95.11 -35.89 11.72 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 120.943 0.402 . . . . 0.0 110.784 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.607 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -58.92 -38.99 80.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.175 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.472 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -66.64 -41.6 88.02 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.825 -179.338 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.698 HG23 ' HA ' ' A' ' 456' ' ' GLU . 12.7 mt -81.05 -30.07 11.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.923 ' HG ' HD22 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -49.36 -56.93 7.91 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.208 0.447 . . . . 0.0 112.208 -178.622 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.677 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -61.86 -28.94 69.85 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -177.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.522 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 16.7 mmm180 -55.05 -22.16 14.94 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.059 0.457 . . . . 0.0 110.714 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.862 HD22 HD11 ' A' ' 463' ' ' LEU . 50.0 mt -63.15 -48.01 80.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.291 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.597 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.9 t-20 55.18 57.36 11.04 Favored Pre-proline 0 C--N 1.321 -0.671 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.898 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.597 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 58.2 Cg_endo -100.36 -160.47 0.04 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.222 0 C-N-CA 124.083 3.189 . . . . 0.0 111.66 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.47 140.33 51.57 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.705 178.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -79.55 135.69 36.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.377 0.608 . . . . 0.0 111.535 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -154.69 147.46 24.37 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.747 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.44 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 6.9 ptm -90.14 108.77 19.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.011 0.434 . . . . 0.0 111.77 -179.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.436 ' N ' ' O ' ' A' ' 510' ' ' LYS . 0.6 OUTLIER -92.7 110.77 23.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.884 178.872 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 59.63 40.39 20.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.932 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . 0.44 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 6.6 m-20 77.11 10.31 2.55 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.524 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.446 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.6 tpmt? -116.09 131.83 56.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.594 0.235 . . . . 0.0 110.679 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 6.6 tpt -66.61 108.42 2.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.119 0.485 . . . . 0.0 111.052 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.66 ' CD2' HG22 ' A' ' 469' ' ' THR . 12.1 m170 -122.74 137.9 54.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.225 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.597 ' CE1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -118.54 122.97 43.95 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.698 0.285 . . . . 0.0 110.721 179.652 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.574 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -168.95 169.8 9.42 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.196 0.522 . . . . 0.0 111.993 -179.302 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.769 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.3 pt? -111.01 169.09 9.0 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.401 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -135.37 106.65 6.78 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.389 -0.524 . . . . 0.0 111.59 179.953 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.538 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.205 -0.902 . . . . 0.0 111.105 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.811 0.339 . . . . 0.0 111.182 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -61.0 86.32 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.915 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.606 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . 0.435 ' O ' ' OD1' ' B' ' 588' ' ' ASP . 3.5 p-10 -86.72 49.14 1.75 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 121.003 0.43 . . . . 0.0 110.872 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.423 ' O ' ' NE2' ' B' ' 589' ' ' HIS . 12.0 pt-20 -87.32 -35.15 18.57 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 121.326 0.584 . . . . 0.0 110.793 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -84.14 -22.5 31.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.56 -178.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' B' ' 585' ' ' ASP . 39.0 p-10 -50.75 -51.53 49.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.879 0.371 . . . . 0.0 111.843 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.423 ' NE2' ' O ' ' B' ' 586' ' ' GLU . 1.8 p-80 -80.52 -21.96 41.36 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.327 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.985 ' CD1' HD21 ' A' ' 474' ' ' LEU . 31.6 tp -54.69 -33.86 61.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.007 -179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 83.2 mt -85.85 -29.62 6.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.896 0.379 . . . . 0.0 110.818 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.552 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.19 -40.72 96.7 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.382 -179.818 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.806 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.91 -18.11 54.41 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.107 0.48 . . . . 0.0 110.211 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.743 ' N ' HD13 ' B' ' 593' ' ' LEU . 79.8 tt0 -62.78 -32.66 73.86 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.001 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.509 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 8.0 pt-20 -79.5 -47.43 15.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.97 -0.559 . . . . 0.0 112.355 -179.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.692 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.0 pp -51.45 -26.7 6.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 120.965 0.412 . . . . 0.0 111.276 -179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.853 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.8 tp -69.87 -83.04 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.492 0.663 . . . . 0.0 111.435 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.673 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 33.2 m -141.77 30.19 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.083 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.527 -178.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.509 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 4.6 mtp-105 -139.06 40.19 2.12 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.166 -179.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . 0.465 ' OXT' HG13 ' B' ' 600' ' ' VAL . 11.2 p . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.189 -0.91 . . . . 0.0 111.092 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.831 0.348 . . . . 0.0 111.271 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.495 HG12 ' N ' ' A' ' 453' ' ' GLN . 45.8 t -60.59 158.64 2.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.085 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.495 ' N ' HG12 ' A' ' 452' ' ' VAL . 1.0 OUTLIER -139.12 140.3 37.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.734 179.925 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.533 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.3 t -87.5 104.83 14.68 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.036 0.446 . . . . 0.0 111.126 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.569 ' O ' HG23 ' A' ' 459' ' ' VAL . 28.4 p -132.1 163.0 29.44 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.516 0.674 . . . . 0.0 112.285 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.57 ' HA ' HG23 ' A' ' 496' ' ' ILE . 15.9 mt-10 -59.35 -54.53 45.74 Favored 'General case' 0 N--CA 1.443 -0.796 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.126 178.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -28.25 19.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.777 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.434 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -77.65 -35.42 52.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.777 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.839 ' CG1' HD21 ' A' ' 500' ' ' LEU . 6.1 t -76.18 -34.85 26.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.684 0.278 . . . . 0.0 111.743 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.562 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 1.2 mmm180 -59.82 -37.22 78.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.643 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.3 OUTLIER -68.95 -31.75 70.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.138 179.313 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.478 ' O ' ' O ' ' A' ' 466' ' ' LYS . 14.7 m-30 -62.17 -45.01 95.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.095 179.259 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.033 HD11 HD22 ' A' ' 500' ' ' LEU . 0.3 OUTLIER -65.9 -59.23 4.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.09 179.774 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.76 HG22 ' CG ' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -49.24 -25.26 2.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.032 0.444 . . . . 0.0 110.424 179.639 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.581 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 45.5 ttt180 -90.98 -31.19 16.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.134 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.674 ' HE2' ' HD3' ' A' ' 467' ' ' PRO . 0.0 OUTLIER 167.15 167.91 0.11 Allowed Pre-proline 0 CA--C 1.532 0.253 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.592 -179.988 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.714 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 84.5 Cg_endo -74.43 160.87 41.15 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.283 1.989 . . . . 0.0 114.113 -178.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.724 ' SD ' HD21 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -150.56 159.33 44.57 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 114.999 -1.001 . . . . 0.0 111.005 -179.008 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.685 ' O ' HD12 ' A' ' 473' ' ' LEU . 17.4 p -108.45 163.41 13.24 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 178.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.514 HG21 ' HA ' ' B' ' 594' ' ' GLU . 0.7 OUTLIER -64.63 -36.76 85.29 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.672 179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.872 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -72.97 -50.22 24.61 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 178.42 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -61.12 -26.2 67.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.474 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.836 HD13 HD11 ' A' ' 497' ' ' LEU . 0.4 OUTLIER -69.1 -46.56 67.43 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.027 0.441 . . . . 0.0 111.152 -179.892 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 1.083 HD22 HG22 ' A' ' 490' ' ' VAL . 2.1 pp -84.19 -31.87 24.88 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.589 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.52 -29.69 2.98 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.84 0.352 . . . . 0.0 110.922 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.481 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -93.12 -35.17 13.33 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.929 179.625 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.533 ' CD2' HG22 ' A' ' 454' ' ' VAL . 12.2 m-85 -73.46 4.41 4.84 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -47.19 174.12 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.014 0.435 . . . . 0.0 111.548 -179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -65.66 -7.51 15.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.871 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 5.2 tmtm? -42.97 -30.93 0.45 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.715 0.293 . . . . 0.0 111.574 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -155.64 -42.03 0.08 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.345 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.41 HG23 ' HB ' ' A' ' 452' ' ' VAL . 0.2 OUTLIER -55.12 -15.94 2.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.211 179.439 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 63.09 19.04 61.02 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.48 -0.867 . . . . 0.0 111.578 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.867 HD21 HG11 ' A' ' 492' ' ' VAL . 6.1 tp -114.07 119.58 37.63 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-O 120.967 0.413 . . . . 0.0 110.983 -179.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.37 145.81 0.16 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.888 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 3.1 t -58.29 -22.56 53.28 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.726 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -91.52 -48.75 6.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.716 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.735 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.0 OUTLIER -63.05 -38.7 92.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.872 179.524 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.413 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 96.7 m -51.69 -30.08 20.64 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 1.083 HG22 HD22 ' A' ' 474' ' ' LEU . 4.6 t -82.72 -40.07 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.349 -0.842 . . . . 0.0 110.087 179.223 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -60.53 -29.99 69.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.057 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.867 HG11 HD21 ' A' ' 484' ' ' LEU . 4.3 p -100.59 -6.98 9.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.94 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.688 ' CD1' HD22 ' A' ' 497' ' ' LEU . 16.7 tp -93.61 -40.17 10.42 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.073 0.463 . . . . 0.0 110.373 179.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.611 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -53.96 -42.12 68.56 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.381 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.507 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -62.47 -40.16 95.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.975 -179.328 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.57 HG23 ' HA ' ' A' ' 456' ' ' GLU . 10.2 mt -78.52 -41.67 25.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 N-CA-C 112.559 0.578 . . . . 0.0 112.559 -178.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.853 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -37.66 -58.73 0.86 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.524 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.692 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.44 -22.98 62.28 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.369 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.479 ' HG3' ' HA ' ' A' ' 496' ' ' ILE . 0.8 OUTLIER -63.56 -18.75 64.19 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.076 0.465 . . . . 0.0 110.457 179.133 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.033 HD22 HD11 ' A' ' 463' ' ' LEU . 34.0 mt -62.69 -47.78 82.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.434 -179.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.647 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 28.0 t-20 55.22 54.52 9.94 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.197 -179.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.647 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 61.2 Cg_endo -101.72 -161.0 0.04 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.084 0 C-N-CA 124.209 3.272 . . . . 0.0 111.712 -179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.76 139.87 51.62 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.565 178.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . 0.447 ' HB2' ' HE1' ' A' ' 511' ' ' MET . 30.1 ptt180 -79.53 132.45 36.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.451 0.643 . . . . 0.0 111.553 -178.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -156.27 130.07 8.43 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.841 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.407 ' HE2' ' HB2' ' A' ' 506' ' ' MET . 0.1 OUTLIER -76.47 112.29 12.84 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.908 0.385 . . . . 0.0 111.535 -179.605 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.445 ' HB ' ' ND1' ' A' ' 512' ' ' HIS . 0.5 OUTLIER -90.52 122.54 42.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.655 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . 0.405 ' ND2' HG22 ' A' ' 507' ' ' ILE . 18.6 p30 48.91 37.56 10.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.436 -179.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . 0.404 ' CB ' ' O ' ' A' ' 508' ' ' ASN . 12.6 t70 80.12 13.03 0.97 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.563 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.431 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 0.0 OUTLIER -116.28 131.48 56.93 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.594 179.715 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.469 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -62.05 108.29 1.02 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.087 0.47 . . . . 0.0 110.635 -179.95 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.566 ' HB3' ' HB2' ' A' ' 467' ' ' PRO . 28.6 m80 -123.26 127.87 49.19 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.861 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.63 ' HB3' HG21 ' B' ' 598' ' ' VAL . 0.0 OUTLIER -104.92 123.73 48.26 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 178.803 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.714 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -178.33 169.47 1.82 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.407 0.622 . . . . 0.0 112.276 -178.756 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.794 HD22 ' C ' ' A' ' 515' ' ' LEU . 0.0 OUTLIER -122.82 168.96 11.6 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.337 178.56 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.97 106.06 8.4 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.207 0.527 . . . . 0.0 111.178 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.76 ' CG ' HG22 ' A' ' 464' ' ' THR . 2.4 pt-20 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.178 -0.915 . . . . 0.0 111.0 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.864 0.364 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -60.91 86.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.569 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . 0.41 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 17.5 t70 -89.97 49.44 1.71 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.974 0.416 . . . . 0.0 110.696 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.485 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 15.1 pt-20 -86.42 -36.37 19.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.975 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.32 -22.88 30.47 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.875 -179.121 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -53.96 -55.11 30.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.008 0.432 . . . . 0.0 111.601 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.485 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.2 p-80 -77.49 -21.91 52.06 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.041 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.918 ' CD1' HD21 ' A' ' 474' ' ' LEU . 26.3 tp -58.47 -37.94 76.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.733 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 64.7 mt -86.01 -29.81 6.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.905 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.571 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.32 -40.83 86.0 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-O 121.063 0.459 . . . . 0.0 110.992 179.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.905 HD21 HG21 ' A' ' 470' ' ' THR . 0.0 OUTLIER -80.14 -18.16 50.55 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.957 179.781 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.797 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.1 OUTLIER -63.41 -32.5 73.95 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.614 179.605 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.508 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 7.7 pt-20 -78.93 -46.87 17.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.385 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.727 HD11 ' HB1' ' A' ' 494' ' ' ALA . 1.6 pp -50.76 -26.63 4.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.09 0.471 . . . . 0.0 110.911 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.897 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.2 tp -71.65 -82.58 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.618 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.681 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.8 m -142.8 30.9 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-N 114.59 -1.187 . . . . 0.0 110.66 -177.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.508 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.2 OUTLIER -139.35 43.28 2.02 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.209 -179.693 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 31.4 m . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.302 -0.856 . . . . 0.0 111.119 179.951 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . 0.516 ' N ' ' HZ2' ' A' ' 481' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.784 0.326 . . . . 0.0 111.214 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.731 ' O ' HG22 ' A' ' 482' ' ' THR . 9.1 p -60.62 154.92 4.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.058 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.418 ' N ' HG22 ' A' ' 452' ' ' VAL . 0.6 OUTLIER -128.08 134.72 49.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.923 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.612 HG22 ' CE2' ' A' ' 477' ' ' PHE . 2.3 t -60.75 118.52 3.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.682 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.488 ' O ' HG23 ' A' ' 459' ' ' VAL . 33.4 p -131.67 172.89 11.71 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.704 0.764 . . . . 0.0 112.489 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.711 ' HA ' HG23 ' A' ' 496' ' ' ILE . 18.2 mt-10 -69.18 -53.26 20.93 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 114.416 -1.266 . . . . 0.0 110.463 179.237 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.04 -28.46 64.51 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.208 -0.905 . . . . 0.0 111.955 -179.5 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.442 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -70.55 -34.34 72.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.569 -179.507 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.802 HG13 HD11 ' A' ' 473' ' ' LEU . 18.6 t -76.15 -37.46 32.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.768 0.318 . . . . 0.0 111.369 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.795 ' O ' HG23 ' A' ' 464' ' ' THR . 1.7 mmm-85 -54.49 -44.57 72.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.073 179.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.497 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -62.83 -29.25 70.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.446 179.4 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.497 ' CD1' ' HG3' ' A' ' 461' ' ' ARG . 10.5 m-30 -68.94 -44.63 72.63 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.114 0.483 . . . . 0.0 109.909 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.013 HD11 HD22 ' A' ' 500' ' ' LEU . 0.7 OUTLIER -67.31 -59.78 3.13 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.224 -179.858 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.795 HG23 ' O ' ' A' ' 460' ' ' ARG . 17.9 p -47.34 -27.38 1.59 Allowed 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.009 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 33.4 mtp85 -88.68 -40.76 13.04 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.015 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.487 ' HD2' ' O ' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -175.96 146.39 0.82 Allowed Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.913 -179.933 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.673 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 39.9 Cg_endo -65.02 151.76 84.68 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.66 2.24 . . . . 0.0 113.115 -179.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.751 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -147.7 163.83 35.46 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.338 0.589 . . . . 0.0 112.072 -179.317 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.625 HG22 ' O ' ' A' ' 511' ' ' MET . 3.0 p -107.62 160.68 15.51 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 177.177 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.905 HG21 HD21 ' B' ' 593' ' ' LEU . 0.2 OUTLIER -53.26 -46.65 69.31 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.865 -179.641 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.867 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -58.97 -57.02 14.91 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.03 179.287 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -60.57 -26.73 67.16 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.759 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.802 HD11 HG13 ' A' ' 459' ' ' VAL . 1.5 tt -77.92 -43.9 28.59 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.02 0.438 . . . . 0.0 111.498 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.918 HD21 ' CD1' ' B' ' 590' ' ' LEU . 2.9 pp -84.07 -32.9 24.55 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.251 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.413 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.1 OUTLIER -50.54 -33.4 21.53 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.801 0.334 . . . . 0.0 111.433 -179.428 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -75.21 -42.02 56.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.338 -179.681 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.612 ' CE2' HG22 ' A' ' 454' ' ' VAL . 12.4 m-85 -63.96 -31.2 72.3 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.035 0.445 . . . . 0.0 110.997 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -62.13 113.95 3.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.915 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 3.0 m 74.47 3.28 4.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.496 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -50.38 70.67 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.816 0.341 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . 0.516 ' HZ2' ' N ' ' A' ' 451' ' ' ASP . 0.0 OUTLIER 174.74 -30.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.154 179.797 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.731 HG22 ' O ' ' A' ' 452' ' ' VAL . 10.5 p -51.86 -21.24 2.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.072 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 66.83 15.18 64.22 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.547 -0.835 . . . . 0.0 111.98 -179.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.411 ' CD2' HG11 ' A' ' 492' ' ' VAL . 0.8 OUTLIER -88.48 129.34 35.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.98 0.419 . . . . 0.0 111.001 -179.656 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -45.22 149.92 0.47 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.561 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . 0.593 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.7 OUTLIER -58.47 -23.31 57.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.176 178.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . 0.407 ' HB3' ' CE1' ' B' ' 589' ' ' HIS . 15.5 mt-10 -86.53 -55.06 4.05 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.613 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -60.0 -40.72 90.19 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.241 179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.417 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 97.7 m -50.55 -33.37 21.53 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 178.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.593 HG23 ' O ' ' A' ' 486' ' ' SER . 4.5 t -76.82 -42.68 33.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.873 178.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -57.19 -25.97 59.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.391 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.526 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 8.0 p -100.57 -14.92 7.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.266 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.854 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.2 OUTLIER -91.36 -32.32 15.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.009 0.433 . . . . 0.0 110.462 179.893 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.781 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -59.3 -39.84 84.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.8 179.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.526 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.5 OUTLIER -65.88 -41.4 91.61 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.679 -179.59 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.711 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.8 mt -78.42 -32.29 16.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.897 ' HB3' HD13 ' B' ' 597' ' ' LEU . 1.1 mm? -49.89 -49.85 48.09 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 -178.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.686 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -66.49 -29.07 69.09 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -178.194 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.57 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 15.4 mmm180 -58.22 -21.69 48.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.992 0.425 . . . . 0.0 110.453 179.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.013 HD22 HD11 ' A' ' 463' ' ' LEU . 37.9 mt -60.74 -47.45 86.22 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.858 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.581 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.0 t-20 56.33 58.56 9.04 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.6 -179.058 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.581 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 95.5 Cg_endo -100.91 -158.95 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 124.027 3.151 . . . . 0.0 111.391 -179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.92 139.98 52.48 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.756 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.47 134.24 36.53 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.381 0.61 . . . . 0.0 111.407 -178.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -156.12 160.16 39.67 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.717 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -104.83 109.36 21.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.901 0.381 . . . . 0.0 111.591 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.516 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.67 110.91 22.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.92 179.072 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 59.58 43.21 16.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.697 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 72.93 12.38 5.14 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.337 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.43 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.7 tpmt? -116.12 132.8 56.55 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.634 0.254 . . . . 0.0 110.918 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.625 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -64.23 108.8 1.67 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.999 0.428 . . . . 0.0 110.715 179.802 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.516 ' CG ' ' HB ' ' A' ' 507' ' ' ILE . 15.9 m80 -122.64 124.87 44.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.034 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.669 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -105.65 123.81 48.54 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 178.565 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.673 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.1 OUTLIER -178.81 169.18 1.65 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.162 0.506 . . . . 0.0 112.153 -178.52 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.705 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.5 pt? -118.95 169.23 10.06 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.452 179.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.402 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -139.78 106.31 5.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.994 0.426 . . . . 0.0 111.33 179.606 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.907 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.755 0.312 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -62.54 83.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.967 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.664 HG21 ' O3P' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . 0.438 ' HA ' ' OD2' ' B' ' 588' ' ' ASP . 10.2 t70 -90.04 49.22 1.67 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 121.005 0.431 . . . . 0.0 110.514 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.481 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 13.5 pt-20 -87.29 -51.89 5.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.035 -0.529 . . . . 0.0 112.025 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . 0.42 ' O ' ' HB3' ' B' ' 590' ' ' LEU . 0.6 OUTLIER -84.91 -33.08 22.8 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -177.932 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . 0.438 ' OD2' ' HA ' ' B' ' 585' ' ' ASP . 6.8 p30 -58.24 -39.68 79.77 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.511 ' HD2' ' N ' ' B' ' 590' ' ' LEU . 1.0 OUTLIER -80.03 -21.0 44.0 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -179.528 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.961 ' CD1' HD21 ' A' ' 474' ' ' LEU . 17.3 tp -48.43 -29.82 4.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.024 0.44 . . . . 0.0 110.624 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . 0.484 HG23 ' OE2' ' B' ' 594' ' ' GLU . 72.8 mt -85.58 -29.55 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.623 179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.586 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -61.35 -42.83 99.34 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.433 -179.705 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.849 ' O ' HD22 ' B' ' 593' ' ' LEU . 0.0 OUTLIER -78.58 -17.71 55.7 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.225 0.536 . . . . 0.0 109.845 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.82 ' N ' HD13 ' B' ' 593' ' ' LEU . 0.4 OUTLIER -63.15 -33.8 76.25 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.671 179.686 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.518 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 7.1 pt-20 -78.6 -46.99 18.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.636 -178.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.682 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 1.5 pp -49.79 -26.68 2.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.101 0.477 . . . . 0.0 111.124 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.899 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.4 tp -72.32 -82.44 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.68 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.711 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.9 m -142.27 30.31 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.036 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.774 -177.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.518 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.2 OUTLIER -139.02 39.31 2.13 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.272 -179.579 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.0 p . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.087 179.939 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.864 0.364 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.419 ' C ' HG22 ' A' ' 482' ' ' THR . 11.0 m -155.22 -168.95 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.886 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.13 121.35 6.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 110.68 179.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.465 HG22 ' CD2' ' A' ' 477' ' ' PHE . 2.5 t -78.58 109.7 13.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.917 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . . . . . . . . . 32.2 p -131.83 168.07 18.47 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.65 0.738 . . . . 0.0 112.233 -179.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.662 ' HA ' HG23 ' A' ' 496' ' ' ILE . 23.6 mt-10 -62.53 -52.96 61.39 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.315 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . 0.418 ' HA ' ' HG2' ' A' ' 460' ' ' ARG . 0.1 OUTLIER -60.83 -28.46 68.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.976 -1.011 . . . . 0.0 112.251 -179.46 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 461' ' ' ARG . . . -67.68 -38.14 83.3 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.863 0.363 . . . . 0.0 111.322 -179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.841 HG13 HD11 ' A' ' 473' ' ' LEU . 21.0 t -72.38 -32.86 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.519 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.947 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.543 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -56.61 -49.61 74.44 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 178.636 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 458' ' ' ALA . 0.0 OUTLIER -59.01 -25.02 63.3 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.727 179.543 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.513 ' HH ' ' HZ ' ' A' ' 477' ' ' PHE . 14.7 m-30 -73.17 -46.54 50.16 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.108 0.48 . . . . 0.0 109.734 178.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.875 HD11 HD22 ' A' ' 500' ' ' LEU . 0.6 OUTLIER -65.72 -57.91 6.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.233 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.855 HG22 ' HB2' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -48.26 -27.76 2.67 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.087 0.47 . . . . 0.0 110.506 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . 0.578 ' O ' ' HD2' ' A' ' 466' ' ' LYS . 31.0 ttt85 -87.98 -32.64 18.74 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.806 179.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.578 ' HD2' ' O ' ' A' ' 465' ' ' ARG . 0.0 OUTLIER 169.29 153.15 0.15 Allowed Pre-proline 0 CA--C 1.53 0.21 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.746 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.675 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 40.3 Cg_endo -64.96 165.45 21.42 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.64 2.227 . . . . 0.0 113.595 -179.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.712 ' CG ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -159.46 152.78 22.34 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.407 -179.125 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.692 HG22 ' O ' ' A' ' 511' ' ' MET . 12.3 p -96.82 155.87 16.59 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.502 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.0 OUTLIER -51.02 -45.86 61.4 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.888 -179.662 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.839 ' CG ' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -59.37 -53.73 54.87 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.033 178.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -61.43 -33.41 73.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.625 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.841 HD11 HG13 ' A' ' 459' ' ' VAL . 0.9 OUTLIER -71.01 -41.39 70.97 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.981 0.42 . . . . 0.0 111.5 -179.583 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.967 ' HB3' HD23 ' A' ' 493' ' ' LEU . 2.4 pp -84.39 -34.77 23.5 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.997 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.429 ' CD ' ' O ' ' A' ' 471' ' ' LYS . 0.0 OUTLIER -48.96 -31.81 8.05 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.716 0.293 . . . . 0.0 111.413 -179.385 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.495 ' HE2' ' CE2' ' A' ' 477' ' ' PHE . 0.0 OUTLIER -81.14 -33.84 32.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.238 -179.871 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.513 ' HZ ' ' HH ' ' A' ' 462' ' ' TYR . 15.1 m-85 -74.86 6.81 3.64 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -46.47 171.34 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.904 0.383 . . . . 0.0 111.51 -179.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . . . . . . . . . 2.8 t -66.04 -5.17 8.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.07 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.21 -30.61 0.5 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-O 120.605 0.24 . . . . 0.0 111.585 -179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.0 -45.24 0.2 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.815 0.34 . . . . 0.0 111.398 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.419 HG22 ' C ' ' A' ' 452' ' ' VAL . 10.8 p -59.11 -13.84 8.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.284 179.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 60.05 21.07 55.46 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.115 -1.04 . . . . 0.0 110.507 -178.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 19.2 tp -111.57 119.58 39.19 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.082 -0.559 . . . . 0.0 111.09 -179.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -40.86 143.87 0.32 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.789 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . 0.646 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.3 OUTLIER -59.88 -22.07 61.85 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.97 0.414 . . . . 0.0 110.002 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -82.69 -52.83 6.42 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.778 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -63.5 -38.79 92.47 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.978 179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.418 HG23 ' HB3' ' A' ' 477' ' ' PHE . 93.0 m -51.45 -30.38 19.41 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.646 HG23 ' O ' ' A' ' 486' ' ' SER . 4.2 t -79.09 -43.15 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.032 179.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -57.12 -25.93 59.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.602 179.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.506 ' O ' ' NE2' ' A' ' 495' ' ' GLN . 7.6 p -100.85 -13.83 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.307 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.967 HD23 ' HB3' ' A' ' 474' ' ' LEU . 0.5 OUTLIER -89.33 -37.07 15.17 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.086 0.469 . . . . 0.0 110.452 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.758 ' HA ' HD23 ' B' ' 593' ' ' LEU . . . -55.32 -40.22 70.9 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.386 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.506 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -63.99 -41.27 97.55 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.156 -179.171 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.662 HG23 ' HA ' ' A' ' 456' ' ' GLU . 9.4 mt -75.08 -45.84 41.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.899 ' HB3' HD13 ' B' ' 597' ' ' LEU . 3.2 mm? -36.3 -59.79 0.61 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.682 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -59.81 -30.16 68.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.774 0.321 . . . . 0.0 111.809 -178.85 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.408 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 1.2 tpt180 -60.29 -24.34 64.88 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.957 0.408 . . . . 0.0 110.75 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.875 HD22 HD11 ' A' ' 463' ' ' LEU . 52.2 mt -61.07 -47.22 87.35 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.69 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.574 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 50.2 t-20 58.45 59.12 6.1 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.962 -179.256 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.574 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 71.5 Cg_endo -101.56 -160.1 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.33 0 C-N-CA 124.045 3.164 . . . . 0.0 111.441 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.82 139.4 53.2 Favored 'General case' 0 N--CA 1.444 -0.77 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 178.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . 0.426 ' O ' ' HG3' ' A' ' 505' ' ' LYS . 7.9 ptt85 -79.69 131.54 35.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.482 0.658 . . . . 0.0 111.758 -178.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' A' ' 504' ' ' ARG . 0.1 OUTLIER -148.26 160.13 43.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.406 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.515 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 7.2 ptm -105.03 108.84 20.57 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.92 0.391 . . . . 0.0 111.295 179.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.557 HG13 ' HG2' ' A' ' 467' ' ' PRO . 0.4 OUTLIER -90.59 110.88 22.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.011 179.274 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 59.7 41.65 18.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.793 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . 0.515 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 1.9 t0 73.95 13.85 4.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.209 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.448 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.8 tpmt? -116.11 132.01 56.78 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.926 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.692 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.15 108.7 1.31 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.095 0.474 . . . . 0.0 110.658 179.759 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.612 ' CE1' HG23 ' A' ' 469' ' ' THR . 19.7 m80 -122.8 127.12 48.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.107 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.627 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -106.54 123.91 48.81 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.646 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.675 ' CB ' ' HA ' ' A' ' 467' ' ' PRO . 0.3 OUTLIER -177.52 169.39 2.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.254 0.55 . . . . 0.0 112.441 -178.66 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.712 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.4 pt? -117.4 169.18 9.71 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.213 -0.903 . . . . 0.0 108.942 178.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.429 ' CD ' ' N ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -138.0 106.45 5.82 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.479 179.787 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.855 ' HB2' HG22 ' A' ' 464' ' ' THR . 8.5 mm-40 . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.761 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.792 0.33 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -61.13 85.61 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.866 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.589 HG23 ' O ' ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . 0.412 ' O ' ' OD1' ' B' ' 588' ' ' ASP . 5.5 p-10 -86.66 49.04 1.73 Allowed 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 120.918 0.389 . . . . 0.0 110.761 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.433 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 12.4 pt-20 -87.09 -31.31 20.53 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.282 0.563 . . . . 0.0 110.658 178.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -84.05 -22.45 31.24 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.392 -178.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . 0.429 ' OD1' ' N ' ' B' ' 589' ' ' HIS . 14.5 p-10 -50.7 -50.26 55.49 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.883 0.373 . . . . 0.0 111.874 -178.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.433 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.0 OUTLIER -80.53 -23.72 39.83 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.353 -179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 0.872 ' CD1' HD21 ' A' ' 474' ' ' LEU . 24.9 tp -55.15 -35.76 65.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.971 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 67.7 mt -85.88 -29.72 6.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.901 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.539 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -67.79 -42.62 81.36 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.474 -179.686 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.846 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -75.33 -22.16 57.84 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.2 0.524 . . . . 0.0 109.925 179.559 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.646 ' N ' HD13 ' B' ' 593' ' ' LEU . 72.4 tt0 -63.32 -30.87 71.93 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.888 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.47 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.0 OUTLIER -76.89 -36.88 56.38 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.362 -179.038 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.96 HD11 ' HB1' ' A' ' 494' ' ' ALA . 4.0 pt -61.4 -26.54 39.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.114 0.483 . . . . 0.0 111.183 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.782 HD13 ' HB3' ' A' ' 497' ' ' LEU . 13.6 tp -72.83 -81.86 0.05 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.646 -0.707 . . . . 0.0 112.03 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.683 HG22 ' HG ' ' B' ' 597' ' ' LEU . 32.2 m -141.41 30.38 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.724 -177.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.47 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 0.6 OUTLIER -137.46 38.87 2.46 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.251 -179.746 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 11.1 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.147 179.921 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.871 0.367 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.798 ' O ' HG22 ' A' ' 482' ' ' THR . 8.7 p -170.27 159.49 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.119 179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.506 ' N ' HG22 ' A' ' 452' ' ' VAL . 0.7 OUTLIER -133.87 140.5 46.88 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.915 -179.808 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.52 HG22 ' CE2' ' A' ' 477' ' ' PHE . 3.4 t -71.76 110.96 5.23 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.339 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.934 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.547 ' O ' HG23 ' A' ' 459' ' ' VAL . 30.4 p -131.84 167.32 19.77 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.665 0.745 . . . . 0.0 112.449 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.708 ' HA ' HG23 ' A' ' 496' ' ' ILE . 19.2 mt-10 -63.04 -53.47 53.25 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 114.561 -1.199 . . . . 0.0 110.505 179.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.37 -28.28 65.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.88 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.438 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -72.63 -34.31 67.22 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.779 -179.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.705 ' CG1' HD21 ' A' ' 500' ' ' LEU . 18.3 t -75.97 -36.77 32.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 C-N-CA 120.905 -0.318 . . . . 0.0 111.476 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.522 ' HD3' HD23 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -54.51 -45.46 73.31 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.932 0.396 . . . . 0.0 110.131 179.135 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.498 ' HG3' ' CD1' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -62.16 -29.31 70.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.891 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.681 ' HD2' HD21 ' A' ' 473' ' ' LEU . 10.7 m-30 -68.3 -44.13 76.11 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.072 0.463 . . . . 0.0 110.178 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 1.03 HD11 HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -67.24 -59.25 3.59 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.305 -179.657 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.674 HG22 ' CG ' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -49.58 -26.25 3.41 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.99 0.424 . . . . 0.0 110.572 179.894 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 12.2 ttt180 -90.07 -46.22 8.63 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.009 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.538 ' HE2' ' HG2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -171.78 131.02 0.73 Allowed Pre-proline 0 CA--C 1.53 0.202 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.916 -179.584 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.618 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 10.7 Cg_endo -52.51 163.25 1.86 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.366 2.044 . . . . 0.0 112.405 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.633 ' HG3' ' HG ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -157.39 159.12 37.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.245 0.545 . . . . 0.0 112.102 -178.609 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.714 HG22 ' O ' ' A' ' 511' ' ' MET . 5.1 p -102.54 155.59 18.17 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.161 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.526 ' CG2' ' HG ' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -51.77 -43.98 63.2 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.27 -0.572 . . . . 0.0 110.859 -179.485 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.844 ' HG2' HD21 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -60.54 -58.81 6.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.284 0.564 . . . . 0.0 109.735 178.855 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.16 -20.28 39.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.498 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.702 HD11 HG13 ' A' ' 459' ' ' VAL . 0.5 OUTLIER -87.57 -40.76 13.98 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.887 0.375 . . . . 0.0 111.702 -179.575 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.976 HD22 HG13 ' A' ' 490' ' ' VAL . 1.3 pp -84.03 -49.73 8.65 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.504 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.59 ' HD3' HD12 ' A' ' 474' ' ' LEU . 18.3 mmtp -48.72 -25.34 1.76 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.76 0.314 . . . . 0.0 111.475 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.534 ' HE2' HD23 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -81.55 -43.59 18.52 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.722 179.818 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.52 ' CE2' HG22 ' A' ' 454' ' ' VAL . 8.3 m-85 -59.95 -30.13 68.88 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 121.092 0.473 . . . . 0.0 110.938 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . 0.703 ' O ' HG23 ' A' ' 479' ' ' THR . 12.0 pt20 -79.12 129.04 34.04 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.264 -179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . 0.703 HG23 ' O ' ' A' ' 478' ' ' GLN . 0.4 OUTLIER -176.48 -77.26 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.721 179.663 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 4.2 tptt -177.77 22.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.702 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 14.2 mmtt -109.08 -71.36 0.77 Allowed 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 120.64 0.257 . . . . 0.0 111.516 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.798 HG22 ' O ' ' A' ' 452' ' ' VAL . 21.0 p -53.22 -12.63 0.41 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.277 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 62.41 20.73 61.47 Favored Glycine 0 N--CA 1.446 -0.665 0 N-CA-C 110.561 -1.015 . . . . 0.0 110.561 -178.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.886 ' CD2' HG11 ' A' ' 492' ' ' VAL . 1.3 tp -103.07 123.57 46.9 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.02 -0.59 . . . . 0.0 111.503 -179.041 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.14 154.95 0.33 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.401 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . . . . . . . . . 5.1 p -61.25 -26.3 67.66 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.515 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -90.73 -42.34 10.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.611 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.603 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.9 mt-30 -65.73 -40.99 92.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.092 179.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.464 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 89.5 m -50.28 -29.42 9.63 Favored 'General case' 0 C--N 1.334 -0.108 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 0.976 HG13 HD22 ' A' ' 474' ' ' LEU . 10.1 t -82.66 -40.85 17.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.004 179.069 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -58.34 -28.2 64.87 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.389 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 0.886 HG11 ' CD2' ' A' ' 484' ' ' LEU . 4.0 p -102.15 -8.89 9.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.384 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.931 HD23 ' HB3' ' A' ' 474' ' ' LEU . 2.3 tp -93.31 -40.59 10.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.043 0.449 . . . . 0.0 110.908 -179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.96 ' HB1' HD11 ' B' ' 596' ' ' ILE . . . -53.26 -45.23 68.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.279 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.459 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -58.84 -35.99 73.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.001 -179.447 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.708 HG23 ' HA ' ' A' ' 456' ' ' GLU . 8.6 mt -81.94 -32.25 11.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -178.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.782 ' HB3' HD13 ' B' ' 597' ' ' LEU . 3.5 mm? -50.98 -48.37 61.2 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.817 ' NZ ' HD12 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -62.02 -32.44 72.93 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -178.72 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.554 ' HG2' ' HA ' ' A' ' 496' ' ' ILE . 0.9 OUTLIER -57.74 -23.44 52.06 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.954 0.407 . . . . 0.0 110.526 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 1.03 HD22 HD11 ' A' ' 463' ' ' LEU . 50.8 mt -59.92 -47.36 86.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.698 -179.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.592 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 26.0 t-20 55.91 57.96 9.79 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.44 -178.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.592 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 87.9 Cg_endo -101.38 -160.52 0.04 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.434 0 C-N-CA 123.879 3.052 . . . . 0.0 111.485 -179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -118.61 141.15 48.87 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.625 178.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -79.42 133.66 36.55 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.396 0.617 . . . . 0.0 111.368 -178.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.8 mtmt -156.15 160.13 39.63 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.842 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.404 ' HA ' ' O ' ' A' ' 510' ' ' LYS . 0.7 OUTLIER -105.16 110.27 22.58 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.902 0.382 . . . . 0.0 111.509 -179.813 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.551 ' HB ' ' CG ' ' A' ' 512' ' ' HIS . 0.4 OUTLIER -90.65 110.92 22.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.781 178.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.5 44.27 15.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.74 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 71.72 13.04 6.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.318 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.442 ' HB3' ' CE1' ' A' ' 512' ' ' HIS . 1.7 tpmt? -116.17 132.03 56.77 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.644 -0.253 . . . . 0.0 110.886 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . 0.714 ' O ' HG22 ' A' ' 469' ' ' THR . 0.0 OUTLIER -63.3 108.66 1.35 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.993 0.425 . . . . 0.0 110.589 179.721 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.569 ' CE1' HG23 ' A' ' 469' ' ' THR . 16.5 m80 -122.68 125.29 45.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.248 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.61 ' CD1' HD21 ' B' ' 597' ' ' LEU . 0.1 OUTLIER -105.22 123.55 48.02 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.516 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.652 ' OG ' HD22 ' A' ' 463' ' ' LEU . 0.4 OUTLIER -177.98 169.38 1.97 Allowed 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.151 0.501 . . . . 0.0 112.21 -178.896 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.723 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.3 pt? -116.57 169.16 9.56 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.286 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.45 106.43 6.65 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.026 0.441 . . . . 0.0 111.35 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.674 ' CG ' HG22 ' A' ' 464' ' ' THR . 4.7 pt-20 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.179 -0.915 . . . . 0.0 111.121 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 582' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.785 0.326 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 583' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -60.4 94.36 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.934 179.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 584' ' ' TPO . . . . . 0.797 ' O3P' HG22 ' B' ' 584' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 585' ' ' ASP . . . . . 0.405 ' O ' ' CE1' ' B' ' 589' ' ' HIS . 3.4 t70 -90.03 49.27 1.68 Allowed 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.962 0.41 . . . . 0.0 110.644 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 586' ' ' GLU . . . . . 0.469 ' O ' ' CD2' ' B' ' 589' ' ' HIS . 17.9 pt-20 -86.34 -41.37 14.58 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.599 179.381 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 587' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.26 -22.7 30.68 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.532 -179.432 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 588' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -51.02 -55.0 19.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.069 0.461 . . . . 0.0 111.611 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 589' ' ' HIS . . . . . 0.469 ' CD2' ' O ' ' B' ' 586' ' ' GLU . 1.2 p-80 -79.57 -21.82 44.59 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.205 -179.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 590' ' ' LEU . . . . . 1.0 HD11 ' HA ' ' A' ' 471' ' ' LYS . 37.9 tp -52.68 -29.56 27.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.937 0.399 . . . . 0.0 111.05 -179.936 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 591' ' ' ILE . . . . . . . . . . . . . 97.3 mt -85.41 -29.5 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 CA-C-O 120.975 0.417 . . . . 0.0 110.786 -179.892 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 592' ' ' TYR . . . . . 0.6 ' CD1' ' N ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -64.91 -45.61 85.16 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.849 -179.507 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 593' ' ' LEU . . . . . 0.788 HD22 ' C ' ' B' ' 593' ' ' LEU . 0.0 OUTLIER -70.02 -18.22 63.3 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.972 0.415 . . . . 0.0 110.373 -179.704 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 594' ' ' GLU . . . . . 0.617 ' N ' HD13 ' B' ' 593' ' ' LEU . 62.5 tt0 -62.8 -30.79 71.74 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-O 120.853 0.358 . . . . 0.0 110.913 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 595' ' ' GLU . . . . . 0.463 ' HA ' ' HB2' ' B' ' 599' ' ' ARG . 0.3 OUTLIER -80.19 -46.2 16.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.952 -0.567 . . . . 0.0 112.038 -179.343 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 596' ' ' ILE . . . . . 0.63 HD13 ' NZ ' ' A' ' 498' ' ' LYS . 2.3 pp -54.91 -26.54 17.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.944 0.402 . . . . 0.0 111.147 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 597' ' ' LEU . . . . . 0.942 HD13 ' HB3' ' A' ' 497' ' ' LEU . 14.8 tp -69.17 -83.31 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.436 0.636 . . . . 0.0 111.833 179.996 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 598' ' ' VAL . . . . . 0.67 ' N ' ' HG ' ' B' ' 597' ' ' LEU . 32.5 m -140.77 30.02 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.593 -177.8 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 599' ' ' ARG . . . . . 0.463 ' HB2' ' HA ' ' B' ' 595' ' ' GLU . 10.4 mtp85 -139.84 39.0 1.99 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.171 -179.576 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 600' ' ' VAL . . . . . . . . . . . . . 30.3 m . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.115 179.965 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 451' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.891 0.377 . . . . 0.0 111.214 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 452' ' ' VAL . . . . . 0.541 ' C ' HG22 ' A' ' 482' ' ' THR . 41.3 t 60.39 154.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.394 179.945 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 453' ' ' GLN . . . . . 0.458 ' N ' HG12 ' A' ' 452' ' ' VAL . 0.0 OUTLIER -156.71 128.43 7.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.329 179.467 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.816 HG22 ' CD2' ' A' ' 477' ' ' PHE . 62.6 t -74.19 104.76 2.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.575 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 455' ' ' THR . . . . . 0.44 ' O ' HG23 ' A' ' 459' ' ' VAL . 16.9 p -131.68 158.29 41.49 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.552 0.691 . . . . 0.0 112.483 -179.336 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 456' ' ' GLU . . . . . 0.745 ' HA ' HG23 ' A' ' 496' ' ' ILE . 17.1 mt-10 -50.19 -52.46 35.46 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.655 -1.157 . . . . 0.0 111.171 179.425 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 457' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.97 -30.75 71.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.376 -179.196 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 458' ' ' ALA . . . . . 0.454 ' O ' ' CG ' ' A' ' 461' ' ' ARG . . . -70.52 -56.8 5.7 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.765 0.317 . . . . 0.0 111.461 -179.523 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.738 ' HB ' HD21 ' A' ' 500' ' ' LEU . 21.0 t -48.84 -26.47 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.711 0.291 . . . . 0.0 111.221 -179.574 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 460' ' ' ARG . . . . . 0.517 ' HG2' ' O ' ' A' ' 456' ' ' GLU . 0.7 OUTLIER -61.73 -49.78 75.06 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.547 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 461' ' ' ARG . . . . . 0.483 ' HG3' ' N ' ' A' ' 462' ' ' TYR . 0.0 OUTLIER -57.94 -30.75 66.22 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.402 179.351 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 462' ' ' TYR . . . . . 0.495 ' CE2' ' CE2' ' A' ' 477' ' ' PHE . 8.5 m-30 -64.54 -42.58 95.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.189 0.518 . . . . 0.0 109.739 178.867 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 463' ' ' LEU . . . . . 0.83 HD11 HD22 ' A' ' 500' ' ' LEU . 0.8 OUTLIER -71.84 -57.89 3.94 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.291 -179.9 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 464' ' ' THR . . . . . 0.586 HG22 ' HB3' ' A' ' 517' ' ' GLU . 0.0 OUTLIER -47.07 -26.44 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.812 179.993 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 465' ' ' ARG . . . . . . . . . . . . . 44.5 mtt180 -91.65 -50.68 5.63 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.116 179.785 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 466' ' ' LYS . . . . . 0.443 ' CE ' ' HD2' ' A' ' 467' ' ' PRO . 0.0 OUTLIER -168.18 132.99 1.47 Allowed Pre-proline 0 N--CA 1.452 -0.352 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.054 -179.774 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 467' ' ' PRO . . . . . 0.511 ' HA ' ' CB ' ' A' ' 514' ' ' SER . 37.1 Cg_exo -57.38 146.71 81.63 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.374 2.049 . . . . 0.0 113.116 -179.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . 0.853 ' SD ' HD12 ' A' ' 473' ' ' LEU . 0.0 OUTLIER -128.97 177.14 7.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.968 -179.571 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 469' ' ' THR . . . . . 0.725 HG22 ' CD2' ' A' ' 512' ' ' HIS . 1.4 p -115.06 157.16 23.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 176.919 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 470' ' ' THR . . . . . 0.537 HG22 ' HG ' ' A' ' 497' ' ' LEU . 0.6 OUTLIER -54.56 -39.56 67.86 Favored 'General case' 0 CA--C 1.512 -0.504 0 C-N-CA 120.159 -0.617 . . . . 0.0 110.664 -179.602 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 1.0 ' HA ' HD11 ' B' ' 590' ' ' LEU . 0.0 OUTLIER -68.97 -60.39 2.4 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.253 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 472' ' ' ASP . . . . . 0.41 ' HB3' ' H ' ' A' ' 469' ' ' THR . 9.6 t70 -52.96 -24.94 10.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.192 179.893 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 473' ' ' LEU . . . . . 0.853 HD12 ' SD ' ' A' ' 468' ' ' MET . 0.7 OUTLIER -69.98 -40.1 75.56 Favored 'General case' 0 CA--C 1.523 -0.069 0 C-N-CA 120.044 -0.662 . . . . 0.0 111.526 -179.438 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 1.039 HD22 HG22 ' A' ' 490' ' ' VAL . 0.9 OUTLIER -84.78 -25.69 28.04 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -179.499 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 475' ' ' LYS . . . . . 0.771 ' HG2' ' O ' ' A' ' 471' ' ' LYS . 68.6 mmtt -57.68 -44.49 85.82 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -178.828 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 476' ' ' LYS . . . . . 0.775 ' HZ1' ' HA ' ' A' ' 473' ' ' LEU . 0.0 OUTLIER -74.39 -43.48 56.21 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.596 179.927 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.816 ' CD2' HG22 ' A' ' 454' ' ' VAL . 5.1 m-85 -59.35 -59.96 4.62 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 178.062 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 478' ' ' GLN . . . . . 0.504 ' O ' ' O ' ' A' ' 477' ' ' PHE . 0.1 OUTLIER 43.22 175.0 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 113.705 -1.588 . . . . 0.0 112.697 178.806 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 479' ' ' THR . . . . . 0.453 ' HB ' ' O ' ' A' ' 484' ' ' LEU . 14.5 t -77.42 -28.49 52.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.025 179.875 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 480' ' ' LYS . . . . . . . . . . . . . 17.3 tptm -56.21 -20.93 20.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.0 -179.305 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 481' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -111.99 -76.27 0.6 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 482' ' ' THR . . . . . 0.541 HG22 ' C ' ' A' ' 452' ' ' VAL . 47.0 p -60.66 -3.23 0.66 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.585 -179.874 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . 63.02 19.96 61.96 Favored Glycine 0 N--CA 1.448 -0.556 0 C-N-CA 120.321 -0.942 . . . . 0.0 111.146 -179.087 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 1.041 HD23 HG11 ' A' ' 492' ' ' VAL . 0.9 OUTLIER -102.42 122.28 43.99 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.504 -0.348 . . . . 0.0 111.098 -179.444 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 485' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -39.35 153.67 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.969 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 486' ' ' SER . . . . . 0.419 ' O ' HG23 ' A' ' 490' ' ' VAL . 0.7 OUTLIER -60.99 -26.15 67.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.261 179.256 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -88.73 -45.95 9.39 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.382 179.537 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 488' ' ' GLN . . . . . 0.764 ' O ' HG12 ' A' ' 492' ' ' VAL . 1.5 mt-30 -63.48 -41.08 98.59 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.921 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 489' ' ' THR . . . . . 0.463 ' O ' ' HB2' ' A' ' 493' ' ' LEU . 86.0 m -50.28 -30.51 12.03 Favored 'General case' 0 C--N 1.333 -0.109 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.637 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 490' ' ' VAL . . . . . 1.039 HG22 HD22 ' A' ' 474' ' ' LEU . 7.0 t -83.02 -40.43 16.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.001 179.034 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . 0.427 ' HB3' ' HA ' ' A' ' 488' ' ' GLN . 5.2 t30 -60.98 -30.87 70.53 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.938 178.928 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 492' ' ' VAL . . . . . 1.041 HG11 HD23 ' A' ' 484' ' ' LEU . 5.4 p -98.46 -6.85 9.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.887 179.424 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.761 HD23 HD23 ' A' ' 474' ' ' LEU . 19.8 tp -95.27 -42.01 8.76 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.994 0.426 . . . . 0.0 110.61 179.894 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . 0.545 ' HB2' ' HB2' ' B' ' 593' ' ' LEU . . . -54.45 -33.8 60.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.507 -179.921 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.473 ' NE2' ' O ' ' A' ' 492' ' ' VAL . 0.0 OUTLIER -67.84 -42.79 80.87 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.125 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 496' ' ' ILE . . . . . 0.745 HG23 ' HA ' ' A' ' 456' ' ' GLU . 12.9 mt -76.08 -46.89 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 112.368 0.506 . . . . 0.0 112.368 -179.06 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.942 ' HB3' HD13 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -32.85 -64.33 0.19 Allowed 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -178.483 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 498' ' ' LYS . . . . . 0.63 ' NZ ' HD13 ' B' ' 596' ' ' ILE . 0.0 OUTLIER -61.47 -31.64 71.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.907 0.384 . . . . 0.0 111.575 -178.956 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 499' ' ' ARG . . . . . 0.427 ' N ' ' HG2' ' A' ' 498' ' ' LYS . 2.4 tpt180 -57.59 -23.42 50.77 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.961 179.79 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.83 HD22 HD11 ' A' ' 463' ' ' LEU . 53.1 mt -62.37 -47.5 83.91 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.819 -179.366 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.591 ' N ' ' HD3' ' A' ' 502' ' ' PRO . 50.9 t-20 56.5 58.31 8.83 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.787 -179.349 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 502' ' ' PRO . . . . . 0.591 ' HD3' ' N ' ' A' ' 501' ' ' ASN . 65.2 Cg_endo -101.2 -158.97 0.04 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.338 0 C-N-CA 124.097 3.198 . . . . 0.0 111.536 -179.505 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 503' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.15 141.91 47.99 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.76 178.881 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 504' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -79.57 135.49 36.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.282 0.563 . . . . 0.0 111.44 -179.026 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -155.26 157.44 37.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.256 -0.884 . . . . 0.0 109.809 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 506' ' ' MET . . . . . 0.47 ' HE2' ' HA ' ' A' ' 509' ' ' ASP . 7.4 ptm -105.13 108.93 20.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.994 0.426 . . . . 0.0 111.598 -179.728 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 507' ' ' ILE . . . . . 0.43 HG12 ' HB2' ' A' ' 512' ' ' HIS . 1.2 mm -90.94 110.77 22.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.082 179.225 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 508' ' ' ASN . . . . . . . . . . . . . 2.7 t30 59.03 40.35 22.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.764 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 509' ' ' ASP . . . . . 0.47 ' HA ' ' HE2' ' A' ' 506' ' ' MET . 2.7 t70 76.62 12.12 2.54 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.359 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.447 ' HA ' ' CE ' ' A' ' 510' ' ' LYS . 1.6 tpmt? -116.17 130.65 56.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.765 0.317 . . . . 0.0 110.925 179.696 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 511' ' ' MET . . . . . . . . . . . . . 45.3 mmm -65.7 108.92 2.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.983 0.421 . . . . 0.0 111.023 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . 0.725 ' CD2' HG22 ' A' ' 469' ' ' THR . 15.1 m170 -122.15 135.35 54.78 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.289 179.512 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 513' ' ' PHE . . . . . 0.704 ' CD2' HD21 ' B' ' 597' ' ' LEU . 0.0 OUTLIER -110.55 123.44 49.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.664 0.269 . . . . 0.0 111.08 -179.896 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 514' ' ' SER . . . . . 0.716 ' OG ' HD22 ' A' ' 463' ' ' LEU . 2.1 m -174.51 169.57 3.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.475 0.655 . . . . 0.0 112.563 -179.691 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 515' ' ' LEU . . . . . 0.779 HD23 ' H ' ' A' ' 515' ' ' LEU . 1.1 pt? -114.35 169.04 9.33 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.915 -1.039 . . . . 0.0 108.551 178.599 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.414 ' HD2' ' H ' ' A' ' 516' ' ' LYS . 0.0 OUTLIER -132.42 106.54 7.94 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.507 179.849 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.586 ' HB3' HG22 ' A' ' 464' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.215 -0.897 . . . . 0.0 111.076 179.987 . . . . . . . . 2 2 . 1 stop_ save_