data_2mq3_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 2mq3 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo . . . . . 0 N--CA 1.458 -0.577 0 N-CA-C 111.537 -0.216 . . . . 62.32 111.537 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 48.2 t -66.34 115.83 4.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.623 -0.51 . . . . 72.43 109.623 176.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -78.59 143.57 36.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.172 -0.467 . . . . 62.42 110.884 -174.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . 0.495 HG22 ' HB1' ' A' ' 534' ' ' ALA . 37.8 mm -95.49 110.77 24.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.356 -0.609 . . . . 73.44 109.356 175.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' THR . . . . . 0.416 ' HB ' ' HG3' ' A' ' 476' ' ' GLU . 16.5 m -67.99 -40.91 82.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.019 0.438 . . . . 74.13 111.318 -175.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.701 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 19.5 mmt85 -116.67 120.39 34.43 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.152 -0.476 . . . . 64.1 110.472 -176.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -76.12 165.53 29.48 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 121.935 1.757 . . . . 71.33 110.45 170.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.435 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 3.7 mm? -80.43 149.03 30.29 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.647 -0.421 . . . . 65.14 109.98 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 23.5 mp0 -52.62 119.38 4.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.267 -0.879 . . . . 63.44 111.999 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -92.01 -11.24 36.53 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.819 -1.082 . . . . 72.24 112.154 -176.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -88.69 155.12 19.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.166 0.508 . . . . 70.21 111.139 -172.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 9.4 tt -87.81 136.14 33.08 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.624 -0.716 . . . . 73.44 109.751 -174.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 35.7 m -121.44 175.65 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.987 -0.552 . . . . 75.34 110.937 -176.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' MET . . . . . 0.438 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 25.2 ptt? -120.85 152.25 38.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.199 -0.455 . . . . 72.33 111.077 -176.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 69.3 t -61.55 139.33 20.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.463 -0.79 . . . . 73.23 111.244 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.35 -18.34 54.01 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.76 -0.733 . . . . 72.3 114.105 173.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 466' ' ' MET . 9.7 pt20 -94.33 155.47 16.98 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 117.836 0.818 . . . . 75.12 110.953 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . 0.497 ' HG3' ' HA ' ' A' ' 515' ' ' ASN . 42.6 ttm180 -88.02 116.0 25.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.787 -0.642 . . . . 73.23 109.832 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 10.4 t -112.78 127.6 69.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.987 0.422 . . . . 65.52 110.877 -175.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -104.59 123.63 47.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.774 -0.648 . . . . 73.12 110.048 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.582 ' HE2' HD11 ' A' ' 514' ' ' ILE . 67.5 m-85 -107.39 134.34 50.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.209 -0.45 . . . . 72.43 109.941 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -122.96 118.43 27.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.03 0.443 . . . . 74.14 111.37 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.701 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 23.0 t -143.08 113.56 7.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.743 -0.662 . . . . 74.32 109.539 176.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.67 ' HB2' ' HA ' ' A' ' 509' ' ' ARG . 13.0 pt-20 -133.51 166.42 22.61 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.291 -0.413 . . . . 75.15 110.841 -177.01 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.516 HG22 ' HB3' ' A' ' 482' ' ' ALA . 6.7 m -101.09 159.56 3.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.757 -0.656 . . . . 72.1 110.505 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 22.2 t -80.79 -2.28 46.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.151 -0.477 . . . . 73.34 111.227 -176.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -134.17 132.8 40.23 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.691 -0.485 . . . . 65.14 109.691 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -78.94 153.02 30.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.179 0.514 . . . . 73.44 112.007 -173.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 95.62 -16.85 60.42 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.52 -0.763 . . . . 61.41 112.359 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.516 ' HB3' HG22 ' A' ' 477' ' ' VAL . . . -82.77 132.84 35.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.199 0.523 . . . . 72.43 111.521 -177.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -105.15 165.13 11.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.507 -0.769 . . . . 65.31 110.189 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.489 HG21 HD13 ' A' ' 527' ' ' LEU . 27.3 m -137.0 173.22 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.39 -0.368 . . . . 71.24 110.997 -174.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -117.44 140.32 49.74 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.08 -0.509 . . . . 65.24 109.649 174.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -98.71 124.05 43.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.152 0.501 . . . . 75.41 110.445 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . 0.406 ' HB3' ' HB2' ' A' ' 526' ' ' ALA . 53.2 tp -115.68 119.21 35.33 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.032 -0.729 . . . . 75.32 109.032 177.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.414 ' HE2' ' HA3' ' A' ' 523' ' ' GLY . 14.0 tmtt? -121.17 113.05 19.44 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.348 -0.387 . . . . 75.2 110.778 -175.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . 0.454 ' HB2' ' HA3' ' A' ' 523' ' ' GLY . 35.1 t0 55.22 37.92 29.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.483 -0.78 . . . . 70.41 111.43 173.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 85.03 -4.13 86.02 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.731 -0.747 . . . . 63.34 112.743 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 44.3 t -103.63 131.86 51.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 120.782 0.325 . . . . 71.33 110.387 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -83.29 113.96 21.06 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.669 -0.493 . . . . 74.24 109.669 177.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 92.9 mt -69.32 159.88 32.31 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.184 -0.462 . . . . 72.03 111.263 -176.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' THR . . . . . 0.628 HG22 ' HG2' ' A' ' 496' ' ' GLU . 7.5 t -89.54 155.14 19.47 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.771 -0.649 . . . . 75.12 110.175 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.5 ttt-85 -79.25 77.04 5.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.724 0.297 . . . . 63.53 110.547 -177.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . 0.628 ' HG2' HG22 ' A' ' 494' ' ' THR . 8.4 pt-20 -176.46 147.25 0.66 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.891 -0.595 . . . . 74.44 109.749 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . 0.45 ' HB2' ' HA ' ' A' ' 502' ' ' TRP . 1.0 OUTLIER -104.52 171.32 7.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.966 0.412 . . . . 72.02 110.398 177.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 7.8 t -149.04 -178.16 6.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.457 -0.572 . . . . 71.21 109.457 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -77.88 -3.84 43.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.793 0.33 . . . . 74.34 111.346 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -82.8 -48.62 10.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.352 0.596 . . . . 75.11 109.535 174.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.609 ' HD2' HD13 ' A' ' 512' ' ' LEU . 19.7 p90 -151.71 141.66 22.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.364 -0.835 . . . . 75.21 109.371 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 502' ' ' TRP . . . . . 0.508 ' HZ3' ' HB2' ' A' ' 504' ' ' LYS . 55.0 p-90 -140.84 150.51 43.37 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.863 0.363 . . . . 74.14 110.602 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . 0.581 ' HA ' ' O ' ' A' ' 511' ' ' HIS . 41.1 p90 -124.76 139.67 53.64 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.14 -0.482 . . . . 72.12 110.147 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.508 ' HB2' ' HZ3' ' A' ' 502' ' ' TRP . 61.2 tttm -116.44 145.24 43.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.02 0.438 . . . . 73.2 110.688 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -107.0 141.78 37.66 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.52 -0.764 . . . . 73.24 109.911 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . 0.512 ' HB3' ' CG ' ' A' ' 509' ' ' ARG . 38.6 t70 -149.94 87.14 1.46 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.863 -0.421 . . . . 63.33 109.863 170.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.45 -87.96 0.2 Allowed Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.769 -0.65 . . . . 73.04 112.675 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -107.52 -27.23 10.52 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.09 0.471 . . . . 74.21 110.924 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.67 ' HA ' ' HB2' ' A' ' 476' ' ' GLU . 6.7 ptp180 -87.99 143.2 27.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.356 0.598 . . . . 73.42 111.684 -170.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -135.12 126.9 29.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.354 -0.839 . . . . 73.43 109.108 179.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . 0.581 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 25.8 m-70 -121.2 126.79 50.53 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.949 -0.389 . . . . 74.43 109.949 -177.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.609 HD13 ' HD2' ' A' ' 501' ' ' TYR . 62.8 tp -110.66 108.06 17.84 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.806 -0.442 . . . . 63.43 109.806 178.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.412 HD11 ' N ' ' A' ' 513' ' ' ILE . 3.7 mp -105.14 123.83 59.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 120.852 0.358 . . . . 74.41 110.648 -176.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.582 HD11 ' HE2' ' A' ' 473' ' ' PHE . 45.1 mt -105.53 122.15 58.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 74.2 109.522 175.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . 0.497 ' HA ' ' HG3' ' A' ' 470' ' ' ARG . 43.1 m-80 -66.13 -42.01 89.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.922 -0.581 . . . . 74.11 111.976 -172.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -140.94 116.02 9.86 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.352 -0.24 . . . . 74.54 110.352 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . 0.416 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -62.6 123.46 18.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.924 -0.398 . . . . 63.12 109.924 175.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 518' ' ' MET . . . . . 0.412 ' HG3' ' N ' ' A' ' 519' ' ' LEU . 45.0 tpp -132.65 171.94 13.19 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.697 -0.483 . . . . 75.42 109.697 -177.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . 0.412 ' N ' ' HG3' ' A' ' 518' ' ' MET . 3.5 mm? -56.46 -32.28 64.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.571 0.224 . . . . 73.54 111.004 177.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -59.25 -37.25 77.11 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.402 0.62 . . . . 72.25 110.525 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -86.73 -13.22 45.96 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.119 -0.946 . . . . 72.32 110.894 -173.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -66.91 7.62 0.36 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.222 0.823 . . . . 74.33 113.222 -176.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . 0.454 ' HA3' ' HB2' ' A' ' 489' ' ' ASP . . . -79.23 165.96 50.99 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.701 -0.761 . . . . 73.04 112.309 178.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 57.1 m170 -71.07 151.39 44.57 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 122.76 -0.259 . . . . 71.04 110.625 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -124.83 124.86 42.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.19 0.519 . . . . 75.21 111.496 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.406 ' HB2' ' HB3' ' A' ' 487' ' ' LEU . . . -128.77 135.44 49.18 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.919 -0.582 . . . . 71.31 110.348 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.588 HD11 ' SG ' ' A' ' 475' ' ' CYS . 2.1 tt -107.95 107.83 18.71 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.999 -0.546 . . . . 73.12 109.909 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 70.2 m -88.8 114.85 25.86 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.073 -0.512 . . . . 74.51 111.676 -174.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.541 ' HB ' ' O ' ' A' ' 532' ' ' GLY . 9.3 m -119.19 158.16 26.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.681 -0.691 . . . . 73.25 109.669 173.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 12.5 m -68.26 -26.65 65.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.804 0.335 . . . . 74.22 111.387 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -87.89 -90.76 1.07 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.824 -0.703 . . . . 70.32 111.637 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . 0.541 ' O ' ' HB ' ' A' ' 529' ' ' THR . . . -97.34 176.05 31.15 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.639 -0.791 . . . . 63.14 111.272 174.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -141.07 126.95 19.23 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.874 -0.417 . . . . 73.02 109.874 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . 0.495 ' HB1' HG22 ' A' ' 456' ' ' ILE . . . -96.93 117.75 31.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.387 -0.369 . . . . 73.42 110.112 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.404 HD21 ' N ' ' A' ' 536' ' ' ALA . 5.4 tt -120.79 127.82 52.31 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.331 -0.618 . . . . 64.22 109.331 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.435 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -148.55 153.88 39.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.267 -0.424 . . . . 74.4 110.157 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -119.18 118.86 32.46 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.373 0.606 . . . . 70.13 110.775 -176.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 44.3 tp -96.86 136.71 37.03 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.942 -1.026 . . . . 75.34 110.125 -177.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.408 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 65.6 mt -116.77 113.36 42.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.148 -0.478 . . . . 73.1 109.783 175.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 44.1 t -101.74 105.48 18.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.886 -0.597 . . . . 73.32 109.695 178.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -88.49 151.15 22.73 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.241 0.543 . . . . 72.13 111.267 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -76.82 162.76 27.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.261 -0.881 . . . . 73.04 112.214 -169.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.405 ' HB3' ' NZ ' ' A' ' 543' ' ' LYS . 8.2 mtpm? . . . . . 0 C--O 1.251 1.159 0 CA-C-N 115.087 -0.96 . . . . 75.43 109.174 173.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo . . . . . 0 N--CA 1.462 -0.37 0 N-CA-C 111.447 -0.251 . . . . 73.14 111.447 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.445 HG23 ' HB3' ' A' ' 530' ' ' SER . 48.3 t -67.12 110.21 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.809 0.338 . . . . 65.24 110.597 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 86.6 mt -78.83 130.47 35.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.968 -0.56 . . . . 75.42 110.524 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 45.7 mm -91.28 110.44 22.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.866 -0.606 . . . . 75.21 110.057 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 26.3 m -79.95 -28.87 39.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.29 -0.414 . . . . 75.05 111.346 -176.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.532 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 36.3 mmt-85 -126.35 119.02 23.26 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.61 -0.268 . . . . 74.31 111.077 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 458' ' ' ARG . 3.0 Cg_exo -76.06 167.27 26.36 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 123.062 2.508 . . . . 64.01 111.548 174.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 91.2 mt -81.94 169.58 16.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.646 0.26 . . . . 75.41 110.609 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -69.57 120.05 14.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.029 -0.532 . . . . 63.42 111.426 -175.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -93.61 -14.36 26.58 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.861 -0.608 . . . . 65.13 111.32 178.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.9 pm0 -90.73 157.42 17.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.335 0.588 . . . . 75.35 111.623 -173.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 10.5 tt -87.48 142.15 28.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.185 -0.916 . . . . 74.52 110.713 -170.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.474 HG21 HG21 ' A' ' 540' ' ' VAL . 28.9 m -126.75 174.0 11.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.996 -0.547 . . . . 70.01 110.269 -179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' MET . . . . . 0.474 ' HG2' ' HG3' ' A' ' 541' ' ' GLN . 46.7 mtm -133.13 162.24 32.26 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.418 -0.355 . . . . 75.44 110.882 -178.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 49.8 t -64.63 137.36 25.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.911 -0.586 . . . . 61.14 111.618 -176.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 100.93 -0.68 55.09 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.764 -0.731 . . . . 71.4 114.039 173.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -120.08 159.0 25.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.42 0.61 . . . . 63.24 110.715 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 514' ' ' ILE . 37.6 ttm105 -87.38 138.59 31.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 63.14 111.176 -175.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 47.1 t -115.96 133.34 62.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.92 -0.582 . . . . 62.32 110.454 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -109.21 122.81 48.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.203 -0.453 . . . . 71.14 110.036 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.647 ' HZ ' HD21 ' A' ' 538' ' ' LEU . 64.9 m-85 -108.31 112.29 24.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.385 -0.371 . . . . 73.25 110.418 176.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.521 ' HG2' ' CE1' ' A' ' 511' ' ' HIS . 33.7 mt-10 -98.71 120.11 38.59 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.284 -0.636 . . . . 64.2 109.284 174.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.532 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 13.9 t -144.84 109.16 4.84 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.089 -0.708 . . . . 73.34 109.089 171.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.506 ' OE1' ' HB2' ' A' ' 509' ' ' ARG . 0.4 OUTLIER -113.93 134.63 54.7 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.699 -0.852 . . . . 74.11 108.699 -176.277 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.494 HG21 ' HB3' ' A' ' 482' ' ' ALA . 30.0 m -95.61 145.23 8.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.567 -0.531 . . . . 64.31 109.567 176.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 32.3 t -72.64 -11.73 60.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.328 -0.396 . . . . 64.35 111.721 -175.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -133.12 137.62 46.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.846 0.355 . . . . 65.04 111.886 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -71.01 149.3 46.77 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.855 -0.611 . . . . 75.31 109.663 174.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 84.42 15.43 68.83 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.663 -0.78 . . . . 72.55 112.34 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.494 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -91.73 110.47 21.81 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.799 0.333 . . . . 72.05 110.733 177.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.53 143.89 55.91 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.948 -0.569 . . . . 63.14 110.515 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 22.3 m -128.62 143.41 41.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.215 -0.448 . . . . 73.54 110.497 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 528' ' ' CYS . 25.1 ttmm -129.09 129.25 44.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.056 -0.52 . . . . 75.53 110.155 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -98.46 119.77 37.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.124 0.488 . . . . 75.51 110.762 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 7.8 tt -116.99 119.74 36.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.734 -0.666 . . . . 74.23 109.331 178.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -105.05 105.73 15.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.418 -0.356 . . . . 74.4 110.815 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . 0.43 ' HB2' ' HA3' ' A' ' 523' ' ' GLY . 4.0 t70 46.88 46.33 15.44 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.257 -0.883 . . . . 65.33 111.33 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.36 -27.25 20.29 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.743 -0.662 . . . . 72.11 113.22 177.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 47.5 t -101.5 119.22 49.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 117.12 0.46 . . . . 63.44 110.775 -176.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -65.32 128.73 37.06 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.725 -0.472 . . . . 71.04 109.725 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 4.4 pp -91.52 163.13 14.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.758 0.313 . . . . 71.44 110.301 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 2.4 p -100.05 142.66 31.23 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.086 0.47 . . . . 72.11 111.583 -176.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.41 2.29 9.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.652 -0.703 . . . . 73.23 111.427 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -126.77 34.68 4.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.156 -0.475 . . . . 70.33 110.767 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -82.98 -179.94 7.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.892 -0.594 . . . . 71.41 111.396 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 13.7 t -65.11 165.71 10.77 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.824 -0.626 . . . . 72.45 111.635 -176.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -74.93 14.26 0.54 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.626 -0.715 . . . . 74.53 112.603 -173.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -59.15 -44.93 92.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.214 0.53 . . . . 75.45 110.218 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.413 ' CB ' HG12 ' A' ' 514' ' ' ILE . 1.5 p90 -144.62 125.04 13.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.516 -0.766 . . . . 74.1 109.681 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -123.26 160.24 27.04 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.831 -0.622 . . . . 74.33 110.162 -174.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -124.02 151.08 44.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.14 0.495 . . . . 65.1 111.357 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -117.16 138.27 51.78 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.524 -0.762 . . . . 71.32 109.939 175.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.763 ' HZ1' ' HB3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -113.77 105.1 12.88 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.66 -0.867 . . . . 75.04 108.66 175.806 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . 0.612 ' HB2' ' HG2' ' A' ' 509' ' ' ARG . 32.4 m-20 -115.39 88.36 2.86 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.565 -0.531 . . . . 73.42 109.565 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 64.15 -94.8 0.16 Allowed Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.873 -0.603 . . . . 73.23 112.584 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . 0.493 ' O ' HG23 ' A' ' 477' ' ' VAL . 20.2 pt20 -103.31 -20.69 14.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.898 0.38 . . . . 75.15 111.108 -177.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.612 ' HG2' ' HB2' ' A' ' 506' ' ' ASP . 28.6 ptt180 -92.28 148.87 21.8 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.441 -0.504 . . . . 74.53 111.075 -172.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -134.47 117.13 15.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.783 -0.644 . . . . 73.2 109.906 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . 0.521 ' CE1' ' HG2' ' A' ' 474' ' ' GLU . 23.1 m-70 -121.22 126.79 50.49 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.806 -0.358 . . . . 73.43 111.098 -177.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 58.3 tp -107.33 117.36 33.86 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.107 -0.701 . . . . 72.51 109.107 176.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 68.6 mt -111.51 108.33 25.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 120.961 0.41 . . . . 71.45 110.871 -175.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.493 ' O ' ' HG3' ' A' ' 470' ' ' ARG . 35.8 mt -86.86 120.55 36.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.543 -0.91 . . . . 75.23 108.543 173.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -68.61 -45.88 70.77 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.899 -0.32 . . . . 74.51 110.715 -176.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -140.61 109.12 5.89 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.641 -0.503 . . . . 72.53 109.641 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . 0.538 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -64.62 136.43 56.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.954 -0.566 . . . . 74.34 111.013 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 72.1 mtm -134.16 174.91 9.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.96 -0.563 . . . . 75.43 110.521 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.53 -33.0 52.96 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.769 0.655 . . . . 64.23 112.769 -171.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.71 -29.7 68.3 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.412 0.625 . . . . 74.25 111.297 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . 0.456 ' HB2' HG22 ' A' ' 540' ' ' VAL . 30.3 m-20 -82.14 -11.86 58.5 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.326 -0.852 . . . . 74.3 111.462 -170.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.467 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -67.22 6.61 0.53 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.394 0.516 . . . . 74.21 112.394 178.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . 0.43 ' HA3' ' HB2' ' A' ' 489' ' ' ASP . . . -80.99 167.99 50.37 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 121.051 -0.595 . . . . 64.22 112.359 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . 0.408 ' CD2' ' HB3' ' A' ' 537' ' ' GLU . 62.8 m80 -79.86 106.58 11.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.688 0.28 . . . . 74.31 110.935 -178.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -76.57 124.36 27.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.383 0.611 . . . . 74.44 111.035 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -123.75 135.95 54.14 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.464 -0.789 . . . . 52.03 109.585 175.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 534' ' ' ALA . 6.2 tt -117.2 108.64 15.91 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.425 -0.583 . . . . 71.23 109.425 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 485' ' ' LYS . 42.3 t -86.76 115.29 24.1 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.051 -0.722 . . . . 73.32 109.051 176.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.3 175.18 6.69 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.501 -0.318 . . . . 70.4 110.417 -176.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 530' ' ' SER . . . . . 0.445 ' HB3' HG23 ' A' ' 454' ' ' VAL . 22.9 t -65.3 -5.99 8.69 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.922 0.391 . . . . 75.44 111.313 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -149.5 -54.81 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.711 -0.757 . . . . 73.1 112.469 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -95.47 -171.49 36.31 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.803 -0.713 . . . . 42.44 112.837 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -140.98 136.93 32.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.876 0.37 . . . . 71.0 110.407 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . 0.582 ' HB3' ' HB3' ' A' ' 527' ' ' LEU . . . -115.98 143.52 45.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.119 -0.491 . . . . 74.24 109.954 176.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 64.3 tp -147.29 126.19 12.75 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.62 -0.264 . . . . 75.21 110.445 -178.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -150.1 152.01 34.09 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.259 -0.428 . . . . 54.21 110.208 177.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . 0.408 ' HB3' ' CD2' ' A' ' 524' ' ' HIS . 10.4 pt-20 -108.38 113.98 27.48 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.148 0.499 . . . . 73.11 110.41 178.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.647 HD21 ' HZ ' ' A' ' 473' ' ' PHE . 39.4 tp -96.3 111.43 23.5 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.928 -0.767 . . . . 72.42 108.928 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 48.4 mt -93.06 112.74 26.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 116.409 -0.36 . . . . 71.45 110.342 -177.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.474 HG21 HG21 ' A' ' 465' ' ' VAL . 24.6 t -109.4 113.14 43.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.831 -0.622 . . . . 71.14 109.787 177.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . 0.474 ' HG3' ' HG2' ' A' ' 466' ' ' MET . 8.0 pt20 -115.18 157.24 23.93 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.023 0.439 . . . . 72.02 110.978 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -78.69 135.23 37.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.541 -0.754 . . . . 74.23 110.282 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 467' ' ' VAL . 59.0 pttt . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.735 -0.65 . . . . 75.4 109.901 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo . . . . . 0 N--CA 1.458 -0.603 0 N-CA-C 111.405 -0.267 . . . . 74.34 111.405 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 56.9 t -66.92 112.48 2.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 109.926 -0.398 . . . . 73.41 109.926 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 89.6 mt -90.06 144.09 26.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.521 . . . . 74.13 111.458 -175.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . 0.472 HD13 HG11 ' A' ' 477' ' ' VAL . 42.9 mm -104.73 113.6 42.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.649 -0.705 . . . . 75.55 109.876 178.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' THR . . . . . 0.434 ' HG1' ' HG3' ' A' ' 476' ' ' GLU . 2.9 p -93.8 -4.84 49.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.843 0.354 . . . . 63.44 111.873 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.6 ' HB2' ' HG2' ' A' ' 476' ' ' GLU . 0.0 OUTLIER -135.02 99.68 12.25 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.562 -0.29 . . . . 74.44 110.544 177.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -71.64 167.15 27.27 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.651 2.234 . . . . 72.3 111.973 174.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.496 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 79.0 mt -83.66 171.05 13.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.275 -0.42 . . . . 72.03 111.407 -175.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . 0.442 ' HB2' ' HE1' ' A' ' 473' ' ' PHE . 7.8 mm-40 -67.7 118.38 10.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.921 -0.581 . . . . 71.54 111.089 -179.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -95.37 -11.24 28.06 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.908 -0.587 . . . . 74.33 111.838 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -88.65 157.5 18.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.293 0.568 . . . . 73.43 111.794 -170.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 8.8 tt -87.24 131.88 34.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.394 -0.821 . . . . 74.21 110.228 -172.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 33.1 m -124.92 176.24 6.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.871 -0.604 . . . . 74.31 110.659 -177.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -113.69 157.51 22.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.046 0.451 . . . . 74.12 110.926 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 73.3 t -66.49 138.67 22.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.549 -0.751 . . . . 74.34 111.272 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.01 -2.06 55.25 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.913 -0.661 . . . . 71.25 114.004 174.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -110.28 163.08 13.99 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 117.671 0.736 . . . . 75.54 111.068 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -82.28 131.03 35.23 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.725 -0.671 . . . . 72.34 110.863 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 60.7 t -131.61 122.0 49.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.243 -0.435 . . . . 74.2 110.169 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.602 ' HG2' HG12 ' A' ' 513' ' ' ILE . 21.8 mt-10 -101.68 138.58 38.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.079 0.466 . . . . 75.45 111.222 176.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.636 ' HZ ' HD21 ' A' ' 538' ' ' LEU . 35.3 m-85 -105.69 112.98 26.27 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.943 -0.762 . . . . 73.01 108.943 171.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.405 ' HB2' ' HE ' ' A' ' 458' ' ' ARG . 42.8 mt-10 -98.29 117.63 33.12 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.467 -0.568 . . . . 63.01 109.467 179.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.487 ' HA ' ' HB3' ' A' ' 458' ' ' ARG . 22.5 t -132.72 125.28 29.87 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.793 -0.447 . . . . 74.44 109.793 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.6 ' HG2' ' HB2' ' A' ' 458' ' ' ARG . 11.3 pt-20 -133.08 153.76 51.21 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.958 -0.564 . . . . 74.11 109.996 178.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.516 HG21 ' HB1' ' A' ' 482' ' ' ALA . 8.1 m -117.37 155.49 19.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 115.465 -0.789 . . . . 64.43 109.906 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 6.5 p -81.16 -2.44 48.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.056 0.455 . . . . 75.23 111.638 -177.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -124.4 130.47 52.54 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.604 -0.887 . . . . 71.44 108.604 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -89.13 132.76 34.67 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.226 0.536 . . . . 73.21 111.605 -174.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 102.73 6.42 46.58 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.81 -0.71 . . . . 74.1 111.975 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.516 ' HB1' HG21 ' A' ' 477' ' ' VAL . . . -82.13 127.53 33.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.694 0.283 . . . . 70.3 110.481 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -80.09 142.85 34.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.117 -0.492 . . . . 73.33 110.671 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.516 HG12 HG22 ' A' ' 529' ' ' THR . 35.7 m -124.04 148.77 28.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.965 -0.561 . . . . 71.31 110.579 -177.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -127.29 134.84 49.98 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.25 -0.432 . . . . 74.23 110.238 178.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -97.85 120.83 38.94 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.941 -0.392 . . . . 74.42 109.941 177.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 51.0 tp -116.82 120.61 39.05 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.651 -0.5 . . . . 74.13 109.651 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.44 ' HD3' ' C ' ' A' ' 488' ' ' LYS . 14.2 tmtt? -109.3 106.89 16.9 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.862 0.363 . . . . 74.35 110.599 -176.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.6 t70 51.02 37.86 18.95 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.534 -0.757 . . . . 65.13 111.871 174.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 91.92 -14.04 65.33 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.769 -0.729 . . . . 52.53 112.641 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 40.0 t -94.33 130.0 43.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.783 0.325 . . . . 73.12 110.171 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -89.96 114.66 26.52 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.546 -0.909 . . . . 74.52 108.546 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.523 HD13 ' O ' ' A' ' 493' ' ' LEU . 2.2 pp -74.0 134.35 43.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.703 0.763 . . . . 75.43 112.125 -172.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.93 174.53 11.52 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.079 -0.964 . . . . 75.23 111.265 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . 0.469 ' N ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -115.81 22.58 12.95 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.865 0.32 . . . . 73.34 111.865 -167.81 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 19.9 pm0 -126.74 20.25 7.15 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.661 0.245 . . . . 74.33 111.661 -177.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -82.87 159.94 22.26 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.579 0.228 . . . . 75.34 110.627 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 14.2 t -75.83 -179.67 4.95 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.149 0.499 . . . . 71.15 111.463 -176.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -81.28 19.64 0.93 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.672 0.619 . . . . 62.45 112.672 -172.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . 0.507 ' O ' ' HB3' ' A' ' 515' ' ' ASN . 58.7 tttp -63.17 -21.52 66.26 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.832 -0.803 . . . . 72.11 108.832 173.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.48 ' HB2' ' HA ' ' A' ' 514' ' ' ILE . 21.1 p90 -155.16 147.42 23.83 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 108.015 -1.105 . . . . 75.32 108.015 167.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 8.5 p-90 -154.09 159.12 41.36 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.212 -0.292 . . . . 75.42 110.212 -175.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -111.31 161.24 16.25 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.699 -0.4 . . . . 74.12 111.309 -177.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.957 ' HG2' ' HB2' ' A' ' 511' ' ' HIS . 14.4 ptpt -129.73 149.54 51.43 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 109.028 -0.73 . . . . 70.44 109.028 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.45 121.37 44.09 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.853 0.359 . . . . 73.22 110.509 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -115.97 80.96 1.52 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.568 -0.53 . . . . 71.42 109.568 175.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.65 -110.33 3.39 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.796 -0.716 . . . . 72.24 112.293 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -95.28 -5.54 43.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.347 0.594 . . . . 74.33 110.191 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.565 ' HG2' ' CB ' ' A' ' 476' ' ' GLU . 68.4 mtt85 -100.17 134.15 43.53 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.592 -0.731 . . . . 74.32 110.546 -175.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -116.51 134.38 54.92 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.825 0.345 . . . . 74.41 110.511 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . 0.957 ' HB2' ' HG2' ' A' ' 504' ' ' LYS . 11.5 m170 -117.91 123.2 45.25 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.111 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.455 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 46.7 tp -98.26 105.6 17.77 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.452 -0.573 . . . . 72.54 109.452 172.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.692 HD12 ' HE2' ' A' ' 504' ' ' LYS . 16.4 mt -93.67 107.6 19.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.937 -0.574 . . . . 73.52 110.451 -176.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.48 ' HA ' ' HB2' ' A' ' 501' ' ' TYR . 45.4 mt -78.13 114.89 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 106.615 -1.624 . . . . 73.25 106.615 168.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . 0.507 ' HB3' ' O ' ' A' ' 500' ' ' LYS . 9.3 t30 -72.51 -42.04 65.24 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.356 0.598 . . . . 65.12 109.838 -176.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -130.95 104.1 6.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.294 -0.866 . . . . 65.34 109.919 174.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -55.64 133.87 50.83 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.218 -0.66 . . . . 63.22 109.218 173.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 518' ' ' MET . . . . . 0.427 ' H ' ' HB3' ' A' ' 521' ' ' ASP . 6.9 tpt -134.18 171.53 14.11 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.814 0.34 . . . . 75.34 111.389 -169.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . 0.771 HD13 ' HB2' ' A' ' 542' ' ' GLU . 3.8 mm? -64.75 -49.27 71.43 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.306 -0.406 . . . . 75.04 111.699 -178.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -67.77 -22.41 65.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.141 0.496 . . . . 63.11 109.88 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . 0.427 ' HB3' ' H ' ' A' ' 518' ' ' MET . 16.6 t70 -74.74 -16.5 60.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.246 -0.888 . . . . 73.42 111.115 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -67.96 7.94 0.47 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.788 0.662 . . . . 61.35 112.788 -178.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . 0.406 ' H ' ' C ' ' A' ' 521' ' ' ASP . . . -73.77 169.42 53.57 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 121.079 -0.581 . . . . 74.11 112.111 178.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 65.1 m170 -72.49 147.07 46.39 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.487 -0.42 . . . . 72.53 110.16 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -119.78 135.53 54.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.143 0.497 . . . . 74.22 111.431 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.428 ' HB2' ' HG ' ' A' ' 535' ' ' LEU . . . -144.06 135.46 25.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.839 -0.619 . . . . 62.13 110.637 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 10.5 tt -113.25 129.37 56.54 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.111 -0.7 . . . . 73.2 109.111 175.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 28.1 t -117.71 137.15 52.88 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.835 0.35 . . . . 74.1 110.27 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.516 HG22 HG12 ' A' ' 484' ' ' VAL . 67.5 p -109.55 -174.2 2.44 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.026 -0.534 . . . . 74.32 109.885 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 3.6 m -66.6 -11.17 52.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.167 -0.47 . . . . 71.3 110.651 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -115.8 -90.47 1.64 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 121.149 -0.548 . . . . 73.21 112.293 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -104.32 -173.06 25.08 Favored Glycine 0 C--O 1.236 0.221 0 C-N-CA 120.675 -0.774 . . . . 54.11 112.613 -178.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -133.83 156.74 47.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.895 0.379 . . . . 74.02 110.802 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -125.62 117.79 24.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.847 -0.615 . . . . 72.13 109.867 175.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.428 ' HG ' ' HB2' ' A' ' 526' ' ' ALA . 7.2 tt -118.37 132.85 56.25 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.347 -0.388 . . . . 75.22 110.414 -176.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.496 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -148.79 142.06 25.11 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.831 -0.622 . . . . 75.51 109.652 176.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -97.74 119.44 36.33 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.405 0.621 . . . . 72.33 111.042 -177.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.636 HD21 ' HZ ' ' A' ' 473' ' ' PHE . 43.8 tp -96.49 112.51 24.23 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.668 -0.697 . . . . 75.43 109.319 177.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 52.9 mt -93.64 112.16 26.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.694 -0.484 . . . . 63.11 109.694 178.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 23.4 t -106.16 110.97 33.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.111 -0.495 . . . . 73.1 110.138 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -94.11 138.4 32.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.09 -0.505 . . . . 74.51 110.789 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . 0.771 ' HB2' HD13 ' A' ' 519' ' ' LEU . 21.3 tt0 -79.18 159.46 27.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.3 -0.409 . . . . 74.34 109.919 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.755 ' HD3' ' HG2' ' A' ' 542' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.473 -0.775 . . . . 74.2 110.498 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo . . . . . 0 N--CA 1.464 -0.261 0 CA-C-O 120.695 0.206 . . . . 74.13 111.737 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.43 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 30.6 t -65.94 123.75 19.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.419 -0.355 . . . . 73.12 110.275 -177.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 6.6 mp -78.55 140.22 38.54 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.953 -0.567 . . . . 51.02 110.859 -177.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . 0.568 HG13 ' HB2' ' A' ' 534' ' ' ALA . 33.7 mm -91.86 112.04 25.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.577 -0.738 . . . . 62.12 109.432 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' THR . . . . . 0.421 ' OG1' ' HG3' ' A' ' 476' ' ' GLU . 0.4 OUTLIER -85.29 -25.62 27.1 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.095 0.405 . . . . 72.12 112.095 -177.041 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.498 ' HB2' ' HG2' ' A' ' 476' ' ' GLU . 6.4 mmm180 -130.61 111.66 16.32 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 110.096 -0.335 . . . . 72.45 110.096 177.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.15 168.5 23.9 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.966 2.444 . . . . 75.13 112.019 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.465 HD13 ' HB3' ' A' ' 473' ' ' PHE . 3.5 mm? -80.22 160.08 25.72 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.924 -0.398 . . . . 71.34 109.924 -178.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . 0.57 ' HB3' ' NE2' ' A' ' 463' ' ' GLN . 27.1 mm-40 -58.55 119.02 6.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.904 -0.589 . . . . 73.21 111.071 -176.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -93.15 -10.94 34.08 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.675 -0.693 . . . . 72.14 111.616 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . 0.57 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 6.0 pm0 -88.53 156.51 19.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.117 0.484 . . . . 73.12 111.254 -174.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 10.5 tt -87.07 138.39 31.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.661 -0.7 . . . . 72.55 110.981 -168.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.52 HG22 HD11 ' A' ' 538' ' ' LEU . 29.7 m -125.98 177.6 5.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.74 -0.664 . . . . 72.12 110.809 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' MET . . . . . 0.476 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 38.1 mtm -133.62 156.1 48.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.758 0.314 . . . . 74.51 111.202 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . 0.48 ' CG2' ' HA ' ' A' ' 542' ' ' GLU . 55.8 t -64.53 144.47 14.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.684 -0.689 . . . . 73.05 111.768 -178.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 102.26 -25.25 28.37 Favored Glycine 0 C--N 1.332 0.307 0 CA-C-N 115.948 -0.569 . . . . 72.24 113.627 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 466' ' ' MET . 13.2 pt20 -98.23 168.35 10.29 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 117.237 0.519 . . . . 64.42 110.365 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 24.9 ttm180 -84.93 136.66 33.53 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.913 -0.403 . . . . 73.22 109.913 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 23.4 t -122.09 122.12 65.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.619 -0.511 . . . . 70.52 109.619 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.523 ' HG2' HG22 ' A' ' 513' ' ' ILE . 49.5 mt-10 -116.54 128.47 55.46 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.74 0.305 . . . . 72.2 110.56 -178.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.705 ' HD2' HD21 ' A' ' 512' ' ' LEU . 20.0 m-85 -105.06 127.15 52.75 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.327 -0.62 . . . . 65.41 109.327 179.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -111.55 116.75 31.36 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.109 0.481 . . . . 71.44 110.048 176.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 25.9 p -138.74 158.21 44.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.678 -0.692 . . . . 62.23 110.042 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.498 ' HG2' ' HB2' ' A' ' 458' ' ' ARG . 7.8 pt-20 -161.24 170.55 20.04 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.368 -0.378 . . . . 75.3 110.16 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.569 HG23 ' HB1' ' A' ' 482' ' ' ALA . 19.9 m -126.16 168.48 19.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.641 -0.708 . . . . 73.22 109.827 177.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 7.8 t -81.26 -1.05 43.49 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.439 -0.346 . . . . 42.11 111.322 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -117.2 133.96 55.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.087 0.47 . . . . 73.41 110.691 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -71.75 124.78 25.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 74.42 111.668 -175.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 71.72 31.91 64.62 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.108 -0.568 . . . . 71.12 113.284 174.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.569 ' HB1' HG23 ' A' ' 477' ' ' VAL . . . -81.56 133.37 35.37 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 122.607 -0.349 . . . . 74.43 110.535 176.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -68.23 142.49 55.62 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.695 -0.684 . . . . 74.44 110.395 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.498 HG13 HG22 ' A' ' 529' ' ' THR . 27.4 m -124.9 146.34 30.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.198 0.523 . . . . 71.1 110.76 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -117.9 135.53 54.05 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.412 -0.813 . . . . 74.43 109.053 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . 0.522 ' HB3' HD11 ' A' ' 493' ' ' LEU . 99.2 m95 -98.05 121.42 39.95 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.219 0.533 . . . . 75.05 110.312 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 20.2 tp -116.11 151.68 35.13 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.409 -0.814 . . . . 73.01 109.292 -178.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -136.86 105.22 5.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.803 0.335 . . . . 73.34 110.454 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 16.0 t70 47.13 40.22 9.49 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.326 -0.852 . . . . 74.53 111.663 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.47 -26.3 24.38 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.808 -0.711 . . . . 74.15 113.212 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 57.9 t -91.64 135.82 26.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 110.032 -0.359 . . . . 54.5 110.032 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -83.53 136.08 34.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.522 0.201 . . . . 75.52 110.564 -177.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.522 HD11 ' HB3' ' A' ' 486' ' ' TRP . 70.1 mt -69.09 153.89 42.98 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.946 -0.39 . . . . 74.43 109.946 178.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' THR . . . . . 0.49 HG23 ' HG2' ' A' ' 496' ' ' GLU . 1.3 m -74.98 142.19 43.92 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.19 0.519 . . . . 74.4 112.104 -170.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 10.6 ptp85 -68.44 -20.75 64.66 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.744 -0.662 . . . . 75.04 110.431 175.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . 0.49 ' HG2' HG23 ' A' ' 494' ' ' THR . 9.1 pt-20 -116.52 39.11 3.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.278 -0.874 . . . . 73.14 109.204 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . 0.481 ' HG2' ' HH ' ' A' ' 501' ' ' TYR . 7.3 tp10 -62.85 154.88 28.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.192 -0.913 . . . . 74.13 111.568 -174.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 9.6 t -60.22 150.6 29.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.511 -0.768 . . . . 73.44 111.396 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -86.23 18.25 3.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.002 -0.544 . . . . 71.22 111.248 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . 0.406 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 39.6 tttp -72.61 -24.24 61.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.358 -0.608 . . . . 71.1 109.358 177.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.481 ' HH ' ' HG2' ' A' ' 497' ' ' GLU . 13.4 p90 -146.14 138.52 25.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.285 -0.871 . . . . 74.44 108.96 173.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -135.39 160.24 39.05 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.855 0.359 . . . . 74.12 111.446 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . 0.409 ' HB3' HD11 ' A' ' 512' ' ' LEU . 40.8 p90 -119.17 138.26 53.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.115 0.483 . . . . 75.34 110.734 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -116.89 131.4 56.96 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.707 -0.678 . . . . 70.33 110.274 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -101.53 128.47 47.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.419 -0.355 . . . . 73.33 110.653 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -135.56 81.75 1.91 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.075 -0.511 . . . . 64.05 109.742 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 75.14 -118.0 5.47 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 121.007 -0.616 . . . . 75.05 112.151 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -86.11 -13.88 45.9 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.94 0.4 . . . . 75.31 110.407 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.489 ' HG2' ' HB3' ' A' ' 476' ' ' GLU . 70.6 mtt180 -97.58 139.14 33.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.408 0.623 . . . . 74.14 111.497 -174.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -130.44 119.18 22.29 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.401 -0.818 . . . . 74.52 109.638 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 41.7 m-70 -105.54 124.91 50.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.438 -0.346 . . . . 74.41 110.189 -177.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.705 HD21 ' HD2' ' A' ' 473' ' ' PHE . 50.6 tp -106.31 105.86 16.1 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.696 -0.483 . . . . 72.0 109.696 176.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.523 HG22 ' HG2' ' A' ' 472' ' ' GLU . 4.8 mp -101.75 110.6 28.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 116.187 -0.461 . . . . 71.33 110.622 -174.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.462 ' HA ' ' CB ' ' A' ' 501' ' ' TYR . 55.4 mt -92.4 116.99 34.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 108.575 -0.898 . . . . 74.5 108.575 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -70.64 -42.76 70.43 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.1 -0.5 . . . . 61.24 111.345 -175.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . 0.406 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 26.2 mt-10 -134.17 105.24 6.56 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.871 -0.604 . . . . 73.44 109.627 -178.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . 0.461 ' O ' HG11 ' A' ' 467' ' ' VAL . . . -56.53 123.04 13.43 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.548 0.53 . . . . 64.23 110.306 177.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 14.4 tpt -113.81 169.09 9.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.133 -0.485 . . . . 73.21 110.111 -175.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . 0.984 ' HG ' ' HG2' ' A' ' 542' ' ' GLU . 7.2 mp -58.12 -33.04 68.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.108 0.48 . . . . 64.24 110.491 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -60.91 -32.48 71.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.473 -0.785 . . . . 74.14 112.233 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -69.32 -14.23 62.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.766 0.317 . . . . 75.3 111.818 -172.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -62.71 -23.23 67.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.086 0.469 . . . . 74.2 110.088 172.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -67.54 123.73 20.35 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.824 -0.91 . . . . 74.31 110.824 173.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -66.76 125.74 26.82 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.127 0.489 . . . . 62.54 111.694 -170.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -92.95 152.48 19.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.594 -0.73 . . . . 73.54 110.522 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.51 143.24 43.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.965 -0.561 . . . . 75.45 110.744 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.459 ' HB2' HD23 ' A' ' 460' ' ' LEU . 58.6 tp -100.97 114.13 27.75 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.049 -0.523 . . . . 61.32 109.907 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 42.3 t -112.89 128.82 56.57 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.191 -0.459 . . . . 63.4 110.08 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.498 HG22 HG13 ' A' ' 484' ' ' VAL . 75.8 p -114.69 -174.3 2.46 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.492 -0.559 . . . . 74.11 109.492 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 12.4 p -68.0 -8.93 41.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.65 -0.25 . . . . 73.4 111.575 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -143.68 -48.55 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.705 -0.759 . . . . 24.43 113.301 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -98.74 156.97 20.22 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.646 -0.788 . . . . 54.0 113.121 -174.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -131.99 125.43 31.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.368 0.267 . . . . 73.33 110.292 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . 0.568 ' HB2' HG13 ' A' ' 456' ' ' ILE . . . -121.53 118.1 28.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.708 -0.224 . . . . 72.13 110.791 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 64.0 tp -109.66 138.96 45.27 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.996 0.427 . . . . 74.41 110.622 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -139.52 145.17 38.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.758 -0.656 . . . . 65.1 109.557 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -105.63 110.0 22.16 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.544 0.688 . . . . 75.24 110.458 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.52 HD11 HG22 ' A' ' 465' ' ' VAL . 49.1 tp -103.39 132.58 49.53 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.534 -0.757 . . . . 72.32 110.037 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.548 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 67.8 mt -117.85 112.92 40.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.723 -0.473 . . . . 72.52 109.723 176.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.406 HG22 HG21 ' A' ' 465' ' ' VAL . 45.8 t -108.39 108.65 25.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.302 -0.408 . . . . 75.41 110.244 -179.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -85.55 134.08 34.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.921 0.391 . . . . 74.13 110.41 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . 0.984 ' HG2' ' HG ' ' A' ' 519' ' ' LEU . 1.0 OUTLIER -83.95 149.82 26.06 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.706 -0.679 . . . . 62.23 111.404 -174.325 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 C--O 1.249 1.046 0 CA-C-N 115.58 -0.736 . . . . 75.21 109.532 175.234 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo . . . . . 0 C--O 1.234 0.275 0 CA-C-O 121.003 0.335 . . . . 71.13 112.494 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 57.3 t -66.87 116.11 5.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.982 -0.553 . . . . 73.51 109.583 175.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.31 153.14 17.82 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.045 0.45 . . . . 75.32 110.977 -174.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 27.7 mm -105.76 117.83 52.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.785 -0.643 . . . . 74.14 109.733 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' THR . . . . . 0.565 ' CG2' ' HB2' ' A' ' 476' ' ' GLU . 15.1 t -91.26 2.63 56.23 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.271 0.558 . . . . 65.33 110.763 -177.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.407 ' HB2' ' H ' ' A' ' 476' ' ' GLU . 75.4 mmt-85 -138.84 94.5 10.14 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.708 -0.678 . . . . 73.21 109.663 173.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -67.45 157.31 62.37 Favored 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.479 2.12 . . . . 71.32 111.467 178.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.423 HD11 ' HB3' ' A' ' 473' ' ' PHE . 3.1 mm? -80.96 146.66 30.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.357 -0.609 . . . . 53.3 109.357 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . 0.641 ' HB2' ' OE1' ' A' ' 463' ' ' GLN . 6.0 pt-20 -82.91 126.77 32.86 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.968 0.889 . . . . 73.12 112.462 -171.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -92.55 -6.94 48.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 113.934 -1.485 . . . . 64.25 112.791 -173.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . 0.641 ' OE1' ' HB2' ' A' ' 461' ' ' GLU . 4.6 pm0 -83.73 161.33 21.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.294 0.569 . . . . 75.2 110.954 -169.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.824 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 1.2 tt -84.72 132.1 34.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.339 -0.846 . . . . 63.42 111.609 -161.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 33.0 m -120.81 177.73 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.357 -0.838 . . . . 63.0 109.693 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' MET . . . . . 0.439 ' O ' ' HB3' ' A' ' 469' ' ' GLN . 23.0 ptp -124.5 163.11 22.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.696 0.284 . . . . 75.01 111.017 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 541' ' ' GLN . 59.6 t -62.53 130.31 26.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 70.13 111.179 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . 0.447 ' HA2' ' HB3' ' A' ' 516' ' ' GLU . . . 93.48 -11.88 70.65 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.937 -0.649 . . . . 72.43 112.353 178.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.439 ' HB3' ' O ' ' A' ' 466' ' ' MET . 29.5 tt0 -76.31 132.37 39.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.951 0.405 . . . . 72.12 111.035 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -73.86 127.04 31.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.609 -0.723 . . . . 75.21 110.251 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 47.5 t -132.52 126.86 55.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.202 -0.454 . . . . 65.24 110.601 -178.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -103.86 131.07 51.42 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.126 -0.324 . . . . 75.4 110.126 174.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.423 ' HB3' HD11 ' A' ' 460' ' ' LEU . 55.0 m-85 -107.07 110.98 23.24 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.124 -0.489 . . . . 72.24 109.748 176.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -104.97 129.86 53.29 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.346 -0.388 . . . . 73.41 110.296 -178.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 9.0 p -143.46 111.68 6.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.219 0.533 . . . . 72.04 110.292 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.565 ' HB2' ' CG2' ' A' ' 457' ' ' THR . 2.0 mm-40 -108.51 132.23 54.03 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.125 -0.694 . . . . 74.44 109.125 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 508' ' ' GLN . 34.9 m -95.33 144.64 9.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 110.044 -0.354 . . . . 63.4 110.044 179.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 58.9 p -85.79 -2.59 58.38 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.81 0.338 . . . . 63.22 111.446 -177.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -124.04 133.16 53.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.334 -0.394 . . . . 73.11 110.222 -178.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -77.98 150.13 33.98 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.018 -0.364 . . . . 65.43 110.018 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 84.41 16.29 66.86 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.495 -0.859 . . . . 71.32 112.116 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.44 110.89 22.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.964 0.411 . . . . 72.3 110.535 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . 0.437 ' O ' ' HA ' ' A' ' 529' ' ' THR . 27.2 mp0 -80.97 157.92 25.37 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.126 -0.694 . . . . 73.34 109.126 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.525 HG13 HG21 ' A' ' 529' ' ' THR . 24.5 m -128.1 143.16 41.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.246 0.546 . . . . 62.21 111.579 -175.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . 0.532 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 21.5 ttmm -127.59 131.69 49.92 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.404 -0.816 . . . . 73.13 109.37 174.18 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . 0.436 ' HB2' HD11 ' A' ' 493' ' ' LEU . 98.0 m95 -98.17 115.91 29.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.303 0.573 . . . . 74.22 110.258 178.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 37.3 tp -116.63 120.89 40.08 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.342 -0.844 . . . . 74.42 109.501 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.469 ' HE2' ' HA3' ' A' ' 523' ' ' GLY . 13.3 tmtt? -109.44 106.65 16.49 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.466 -0.494 . . . . 73.4 110.311 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.08 38.31 20.36 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.164 -0.926 . . . . 73.3 111.808 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.73 -24.16 32.12 Favored Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.87 -0.681 . . . . 71.14 112.586 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.6 t -89.7 124.84 42.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 110.072 -0.344 . . . . 74.04 110.072 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -89.62 119.66 30.24 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.428 -0.582 . . . . 64.24 109.428 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.436 HD11 ' HB2' ' A' ' 486' ' ' TRP . 2.4 pp -72.73 161.64 30.49 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.199 -0.455 . . . . 65.12 111.395 -177.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' THR . . . . . 0.485 ' O ' ' HB2' ' A' ' 497' ' ' GLU . 19.1 m -106.85 142.72 36.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.98 -0.554 . . . . 75.42 110.241 -178.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . 0.414 ' HD3' ' C ' ' A' ' 495' ' ' ARG . 4.3 tmt_? -65.19 -39.91 93.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.345 -0.613 . . . . 75.45 109.345 176.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.25 73.14 3.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.936 -0.575 . . . . 64.11 109.898 171.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . 0.485 ' HB2' ' O ' ' A' ' 494' ' ' THR . 5.0 tp10 -120.21 179.58 4.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.585 -0.734 . . . . 75.23 109.44 -177.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' THR . . . . . 0.438 ' H ' ' HG3' ' A' ' 497' ' ' GLU . 11.2 t -72.5 172.64 10.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.703 0.287 . . . . 72.55 110.345 175.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -79.13 18.21 0.68 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.816 0.341 . . . . 72.41 111.791 -173.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . 0.588 ' HZ1' ' CG ' ' A' ' 521' ' ' ASP . 80.6 tttt -61.4 -35.13 76.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 73.54 111.189 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.518 ' HD2' HD12 ' A' ' 512' ' ' LEU . 25.1 p90 -148.57 150.2 32.92 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.297 -0.411 . . . . 74.3 110.616 -177.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -146.6 142.64 28.16 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.479 -0.563 . . . . 74.34 109.479 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . 0.481 ' HB3' HD13 ' A' ' 512' ' ' LEU . 44.1 p90 -123.3 150.03 44.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.131 0.491 . . . . 74.33 111.34 -176.273 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -127.92 139.7 52.44 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.368 -0.833 . . . . 74.11 110.023 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.2 pptp? -111.07 137.78 48.3 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.691 -0.485 . . . . 75.43 109.691 173.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . 0.613 ' HB3' ' HB2' ' A' ' 509' ' ' ARG . 33.8 t70 -130.45 82.86 2.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.784 -0.644 . . . . 75.25 109.382 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.34 -107.99 2.25 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.704 -0.76 . . . . 65.34 111.661 -174.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . 0.437 ' O ' HG23 ' A' ' 477' ' ' VAL . 15.9 pt20 -89.32 -7.44 55.33 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.454 0.645 . . . . 74.11 110.151 177.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.613 ' HB2' ' HB3' ' A' ' 506' ' ' ASP . 67.8 mtp180 -91.08 147.12 23.29 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.641 -0.709 . . . . 71.44 111.071 -172.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -141.72 115.72 9.29 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.36 -0.607 . . . . 75.32 109.36 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -124.33 122.51 37.91 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.68 0.276 . . . . 71.41 110.574 -175.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.518 HD12 ' HD2' ' A' ' 501' ' ' TYR . 57.4 tp -107.86 126.54 52.79 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.137 -0.483 . . . . 61.03 110.315 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.426 ' N ' HD13 ' A' ' 513' ' ' ILE . 4.2 mp -108.76 113.84 45.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 120.954 0.406 . . . . 73.44 110.737 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . . . . . . . . . 35.5 mm -91.36 121.84 42.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.874 -0.787 . . . . 72.41 108.874 174.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . 0.434 ' N ' HD21 ' A' ' 515' ' ' ASN . 0.9 OUTLIER -66.64 -51.49 55.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.81 0.338 . . . . 72.24 110.397 -177.769 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . 0.447 ' HB3' ' HA2' ' A' ' 468' ' ' GLY . 46.4 mt-10 -145.4 123.55 12.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.917 -0.583 . . . . 74.44 110.131 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -66.48 133.71 50.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.128 -0.487 . . . . 74.13 110.999 178.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 518' ' ' MET . . . . . 0.404 ' HG2' ' H ' ' A' ' 520' ' ' GLU . 55.1 ttm -113.67 155.96 24.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.891 -0.595 . . . . 75.44 109.621 -178.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . 0.689 HD22 ' HB3' ' A' ' 542' ' ' GLU . 84.8 mt -58.81 -32.5 69.43 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.935 0.397 . . . . 62.43 111.623 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . 0.404 ' H ' ' HG2' ' A' ' 518' ' ' MET . 0.9 OUTLIER -60.41 -28.58 68.37 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.143 0.497 . . . . 74.01 110.691 178.454 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . 0.588 ' CG ' ' HZ1' ' A' ' 500' ' ' LYS . 56.7 m-20 -71.32 -11.95 61.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.767 -0.651 . . . . 74.43 112.197 -175.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.48 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -61.66 5.54 0.08 Allowed 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.576 0.584 . . . . 72.02 112.576 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . 0.501 ' H ' ' C ' ' A' ' 521' ' ' ASP . . . -83.91 170.56 47.81 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 116.415 -0.357 . . . . 72.11 112.367 177.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 44.4 m-70 -73.69 118.56 16.79 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 122.65 -0.324 . . . . 72.21 110.559 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . 0.434 ' HB2' ' O ' ' A' ' 536' ' ' ALA . 56.8 m-85 -83.75 133.73 34.77 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.957 -0.386 . . . . 74.33 109.957 172.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.57 134.23 46.84 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.867 0.365 . . . . 70.14 110.514 175.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.515 HD13 ' HB ' ' A' ' 484' ' ' VAL . 57.1 tp -110.33 106.52 15.93 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.866 -0.606 . . . . 72.4 109.939 177.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . 0.532 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 48.7 m -92.52 115.11 27.8 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.218 -0.446 . . . . 74.43 110.113 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.525 HG21 HG13 ' A' ' 484' ' ' VAL . 44.3 p -109.11 -175.01 2.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.909 0.385 . . . . 73.54 110.601 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 14.5 m -72.65 -5.92 40.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.082 -0.508 . . . . 74.32 110.965 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -138.43 -90.38 0.22 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.653 -0.784 . . . . 75.22 112.785 -178.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -97.46 127.28 9.16 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.631 -0.795 . . . . 73.54 112.455 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -95.55 127.1 41.31 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.059 0.457 . . . . 71.14 110.814 178.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -97.23 140.03 32.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.006 -0.543 . . . . 72.41 110.044 178.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 6.0 tt -129.58 123.78 32.18 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.724 -0.473 . . . . 75.3 109.724 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 525' ' ' TYR . . . -145.07 134.76 23.43 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.724 -0.671 . . . . 74.4 109.687 177.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -105.17 137.72 42.5 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 120.844 0.354 . . . . 73.02 110.474 -176.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 522' ' ' ALA . 45.4 tp -96.4 133.95 40.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.879 -0.601 . . . . 74.23 110.201 -174.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.824 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 7.6 mt -104.06 123.78 58.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.98 -0.748 . . . . 63.43 108.98 177.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 45.6 t -118.74 126.37 75.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.584 -0.28 . . . . 75.11 111.22 -174.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . 0.554 ' HG3' ' CD2' ' A' ' 464' ' ' LEU . 74.8 mt-30 -84.82 127.73 34.28 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 116.361 -0.381 . . . . 73.13 111.189 175.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . 0.689 ' HB3' HD22 ' A' ' 519' ' ' LEU . 6.9 pt-20 -91.12 126.81 36.32 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.512 -1.292 . . . . 74.22 107.512 163.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp . . . . . 0 C--N 1.315 -0.92 0 CA-C-O 118.865 -0.588 . . . . 74.35 109.736 -176.609 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo . . . . . 0 N--CA 1.462 -0.38 0 CA-C-O 120.797 0.249 . . . . 71.21 111.794 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.4 ' H ' ' HA3' ' A' ' 531' ' ' GLY . 43.1 t -66.26 106.34 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.112 -0.494 . . . . 63.41 110.219 -177.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 93.6 mt -82.57 147.29 28.7 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.605 -0.725 . . . . 73.41 110.163 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . 0.786 HG13 ' HB1' ' A' ' 534' ' ' ALA . 40.7 mm -94.79 117.35 38.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.942 -0.572 . . . . 73.41 109.908 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' THR . . . . . 0.488 HG22 ' NH2' ' A' ' 458' ' ' ARG . 3.3 m -83.28 -35.63 25.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.218 -0.447 . . . . 73.3 110.583 -177.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.685 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 14.2 mmp_? -115.42 105.57 52.04 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 109.566 -0.531 . . . . 74.43 109.566 176.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -70.75 160.61 48.85 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.784 2.323 . . . . 71.23 111.785 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.466 ' HB2' ' CB ' ' A' ' 536' ' ' ALA . 94.8 mt -81.77 169.4 16.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.763 0.316 . . . . 65.33 110.98 -177.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -64.7 118.12 8.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.961 -0.563 . . . . 55.21 111.444 -175.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -94.76 -11.75 28.43 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.865 -0.607 . . . . 72.42 111.503 177.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -89.51 159.73 17.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.196 0.522 . . . . 74.24 111.778 -171.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 8.4 tt -85.81 137.06 33.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.51 -0.768 . . . . 74.32 110.258 -173.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.573 HG22 HG21 ' A' ' 540' ' ' VAL . 22.8 m -130.45 175.99 9.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.623 -0.717 . . . . 64.44 110.476 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' MET . . . . . 0.485 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 65.8 mtt -111.21 150.74 29.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.638 0.256 . . . . 73.11 110.975 -178.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.5 142.56 16.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.303 -0.408 . . . . 74.04 110.72 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.06 -25.49 28.12 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.946 -0.645 . . . . 74.24 113.635 175.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 466' ' ' MET . 13.1 pt20 -89.26 164.82 14.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.25 0.525 . . . . 71.55 110.444 -178.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . 0.51 ' HG3' ' O ' ' A' ' 514' ' ' ILE . 33.9 ttm180 -88.81 129.39 35.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.909 0.385 . . . . 74.44 111.215 -174.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -124.92 139.92 49.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.495 . . . . 72.11 110.206 -177.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -125.69 134.12 51.93 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.753 0.311 . . . . 55.54 110.643 -178.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.749 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 81.8 m-85 -107.12 116.32 31.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.207 -0.451 . . . . 70.1 110.625 177.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -100.06 118.14 35.81 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.628 -0.715 . . . . 71.24 109.606 177.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.685 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 27.6 t -134.89 141.29 46.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.299 0.571 . . . . 72.32 111.305 -178.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.612 ' HG3' ' HG2' ' A' ' 509' ' ' ARG . 42.7 tt0 -138.45 136.85 36.62 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.298 -1.001 . . . . 74.43 108.298 176.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.505 HG23 ' HB1' ' A' ' 482' ' ' ALA . 18.0 m -104.07 154.68 5.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 C-N-CA 121.167 -0.213 . . . . 64.22 110.459 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 45.4 m -82.61 -2.22 53.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.814 0.34 . . . . 75.42 111.622 -178.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -111.21 141.29 44.92 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.612 -0.514 . . . . 73.14 109.612 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -86.24 138.41 31.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.153 -0.476 . . . . 74.42 111.202 -173.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 62.13 39.1 97.2 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.922 -0.656 . . . . 73.31 112.212 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.505 ' HB1' HG23 ' A' ' 477' ' ' VAL . . . -103.34 112.03 24.72 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.078 0.466 . . . . 71.14 111.065 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -73.31 154.31 40.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.594 -0.73 . . . . 75.42 109.594 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.409 HG13 HG23 ' A' ' 529' ' ' THR . 35.7 m -124.63 161.26 28.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.897 0.379 . . . . 72.55 111.022 -175.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' A' ' 527' ' ' LEU . 12.3 ttmm -116.64 128.77 55.69 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.731 -0.668 . . . . 72.3 109.682 177.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 89.9 m95 -98.82 115.35 28.61 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.306 -0.627 . . . . 75.53 109.306 175.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 28.6 tp -119.6 119.2 33.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.032 -0.531 . . . . 73.4 110.393 -177.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.471 ' O ' ' HD3' ' A' ' 488' ' ' LYS . 13.3 tmtt? -109.74 106.79 16.56 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.013 -0.366 . . . . 71.33 110.013 177.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.1 t70 49.19 38.46 13.32 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.461 0.648 . . . . 74.21 111.491 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.45 -17.21 58.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.707 -0.759 . . . . 64.12 113.014 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.6 t -84.89 117.14 29.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.803 0.302 . . . . 74.34 110.729 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -97.89 117.67 32.75 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.44 -0.578 . . . . 74.53 109.44 176.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.9 pp -73.97 163.11 28.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.177 0.513 . . . . 73.54 112.008 -175.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 34.9 p -106.72 174.42 5.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.619 -0.719 . . . . 72.24 111.541 -177.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -63.14 -47.47 82.58 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.324 0.583 . . . . 75.22 111.202 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -95.52 50.51 1.24 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.824 -0.625 . . . . 74.33 110.23 -176.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -76.45 169.75 17.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.905 -0.589 . . . . 72.32 110.649 -176.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 4.7 t -57.75 150.97 18.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.155 0.502 . . . . 55.51 111.898 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -85.19 7.21 22.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.862 -0.608 . . . . 72.12 111.123 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . 0.48 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 54.3 tptt -62.06 -37.34 84.63 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.483 0.659 . . . . 75.0 109.337 174.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.485 ' HB2' HG12 ' A' ' 514' ' ' ILE . 8.4 p90 -152.19 131.64 12.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.954 -1.021 . . . . 71.54 108.681 175.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -139.0 161.51 37.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.096 0.474 . . . . 72.12 111.755 -175.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -119.0 139.64 51.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.834 -0.621 . . . . 70.35 110.755 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.421 ' HE2' ' HB3' ' A' ' 504' ' ' LYS . 40.7 mtpt -127.59 149.69 50.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.11 -0.495 . . . . 75.11 109.921 176.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.458 ' O ' ' HD3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -106.62 146.9 30.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.2 0.524 . . . . 73.32 111.478 -176.108 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -147.31 99.07 3.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.361 -0.836 . . . . 63.01 109.546 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 61.83 -123.65 32.16 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.453 -0.88 . . . . 64.33 111.107 -173.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -96.92 7.34 46.85 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.172 0.51 . . . . 74.43 110.423 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.612 ' HG2' ' HG3' ' A' ' 476' ' ' GLU . 74.8 mtm180 -95.26 152.29 18.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.044 -0.525 . . . . 62.13 110.032 177.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -136.94 128.25 28.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.966 -0.383 . . . . 63.42 109.966 -178.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -111.01 123.91 51.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.515 -0.311 . . . . 63.5 110.198 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.749 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 58.2 tp -110.28 104.47 13.28 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.511 -0.551 . . . . 70.45 109.511 174.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.441 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.3 mp -101.38 115.55 43.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.239 -0.437 . . . . 73.0 110.515 -175.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.51 ' O ' ' HG3' ' A' ' 470' ' ' ARG . 51.8 mt -97.74 119.42 45.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.898 -0.779 . . . . 75.54 108.898 173.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -69.1 -39.56 78.9 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.366 -0.379 . . . . 73.23 110.88 -177.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . 0.48 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 41.4 mt-10 -146.83 113.17 5.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.908 -0.587 . . . . 73.01 109.617 178.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -58.43 143.23 46.08 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 123.517 0.511 . . . . 71.14 111.385 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 88.0 mtp -123.38 172.9 8.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.102 -0.499 . . . . 64.02 110.301 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . 0.476 HD11 ' O ' ' A' ' 519' ' ' LEU . 2.6 tm? -60.7 -31.36 70.64 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.956 -0.387 . . . . 72.34 109.956 177.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -52.44 -28.62 20.76 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.073 -0.512 . . . . 71.13 111.87 177.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . 0.543 ' HA ' ' HE1' ' A' ' 525' ' ' TYR . 42.6 m-20 -68.16 -15.38 63.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.379 -0.373 . . . . 73.03 111.802 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.491 ' HB2' HG13 ' A' ' 540' ' ' VAL . . . -71.04 -12.86 61.76 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.13 0.49 . . . . 73.3 110.225 174.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -77.66 156.53 44.6 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 111.138 -0.785 . . . . 30.53 111.138 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -81.79 117.19 21.89 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.189 0.518 . . . . 64.52 111.044 -176.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . 0.543 ' HE1' ' HA ' ' A' ' 521' ' ' ASP . 73.4 m-85 -88.96 133.76 34.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.205 -0.907 . . . . 74.24 110.667 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -123.59 135.02 53.74 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.081 -0.509 . . . . 73.25 110.36 176.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.417 ' HA ' ' O ' ' A' ' 485' ' ' LYS . 9.4 tt -109.8 111.0 22.17 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.883 -0.784 . . . . 74.13 108.883 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 42.1 t -109.5 136.31 49.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.29 -0.414 . . . . 71.51 110.721 -176.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.409 HG23 HG13 ' A' ' 484' ' ' VAL . 82.3 p -118.22 -175.65 2.9 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.69 -0.485 . . . . 73.4 109.69 175.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 13.7 m -69.18 -9.08 51.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.761 0.315 . . . . 74.32 110.942 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . 0.4 ' HA3' ' H ' ' A' ' 454' ' ' VAL . . . -124.85 -65.97 0.19 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.395 -0.907 . . . . 75.22 112.896 -177.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -113.52 171.45 13.84 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.676 -0.773 . . . . 70.11 112.498 -176.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -138.62 130.34 27.78 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.775 0.321 . . . . 74.21 110.561 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . 0.786 ' HB1' HG13 ' A' ' 456' ' ' ILE . . . -109.47 120.97 44.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.209 -0.451 . . . . 74.44 110.157 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 5.3 tt -109.05 121.2 44.64 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.093 -0.706 . . . . 75.22 109.093 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.466 ' CB ' ' HB2' ' A' ' 460' ' ' LEU . . . -119.2 132.13 55.91 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.065 0.46 . . . . 73.33 110.478 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -99.46 108.73 21.26 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.38 0.61 . . . . 73.43 109.691 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.416 HD23 ' HB3' ' A' ' 521' ' ' ASP . 37.0 tp -97.78 136.1 38.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.331 -0.85 . . . . 75.2 109.459 -177.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 31.5 mt -113.03 112.36 40.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.84 -0.43 . . . . 73.42 109.84 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.573 HG21 HG22 ' A' ' 465' ' ' VAL . 4.4 p -113.91 133.34 60.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 108.803 -0.814 . . . . 73.25 108.803 176.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -110.21 148.18 32.34 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.107 0.479 . . . . 73.4 111.407 -176.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.36 146.97 50.1 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.012 -0.994 . . . . 70.02 110.786 -178.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.437 ' HD2' ' HB3' ' A' ' 466' ' ' MET . 55.9 mtpt . . . . . 0 C--O 1.244 0.803 0 CA-C-O 118.629 -0.7 . . . . 73.44 109.323 175.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo . . . . . 0 N--CA 1.464 -0.247 0 CA-C-O 120.956 0.315 . . . . 72.25 112.068 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.68 132.35 32.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.991 -0.55 . . . . 74.11 110.674 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.9 137.26 34.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.922 -0.581 . . . . 73.52 110.857 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . 0.559 HD11 HG13 ' A' ' 477' ' ' VAL . 32.9 mm -95.43 119.08 43.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.734 -0.666 . . . . 73.34 109.717 177.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' THR . . . . . 0.766 ' HB ' ' HG3' ' A' ' 476' ' ' GLU . 7.5 m -86.89 -23.54 25.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 73.21 111.18 -177.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.797 ' HG2' ' HG2' ' A' ' 476' ' ' GLU . 22.5 mmt180 -123.35 117.32 28.04 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.598 -0.274 . . . . 70.34 111.671 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -83.42 167.12 13.71 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 123.02 2.48 . . . . 75.42 111.414 173.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -89.49 169.96 10.92 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.617 0.246 . . . . 55.13 110.87 -178.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -71.18 118.64 14.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.275 -0.42 . . . . 74.43 110.453 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -93.94 -13.47 27.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.171 -0.468 . . . . 74.24 111.27 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -89.66 155.32 19.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.136 0.493 . . . . 62.01 111.131 -173.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 8.0 tt -88.95 133.13 34.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.708 -0.678 . . . . 74.31 110.352 -173.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 28.7 m -127.49 176.67 6.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 63.21 111.035 -177.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 26.4 mmt -113.86 152.91 30.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.323 -0.399 . . . . 75.41 111.272 -176.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 517' ' ' ALA . 83.1 t -68.14 144.69 14.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.549 -0.751 . . . . 71.01 110.787 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.52 -2.26 53.39 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.911 -0.661 . . . . 54.2 113.973 175.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -114.57 164.34 14.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.471 0.636 . . . . 74.04 110.475 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 27.2 ttt85 -84.92 132.88 34.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.975 0.417 . . . . 74.54 111.166 -177.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.489 ' O ' ' HB ' ' A' ' 514' ' ' ILE . 50.5 t -131.67 138.57 52.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.862 -0.608 . . . . 61.13 109.605 177.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -131.78 139.44 48.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.778 0.323 . . . . 64.22 110.461 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 93.5 m-85 -121.27 109.61 15.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.929 -0.578 . . . . 64.41 110.154 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -106.43 117.09 33.13 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 119.909 -0.716 . . . . 70.04 109.467 173.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.74 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 7.7 p -122.8 123.41 40.98 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.555 -0.748 . . . . 62.11 109.974 -178.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.797 ' HG2' ' HG2' ' A' ' 458' ' ' ARG . 13.3 pt-20 -125.42 145.09 50.22 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.909 0.385 . . . . 74.43 110.239 -177.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.559 HG13 HD11 ' A' ' 456' ' ' ILE . 17.9 m -111.49 164.63 7.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.782 -0.645 . . . . 73.43 109.543 178.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 15.6 t -78.16 -18.0 56.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.728 0.299 . . . . 74.14 111.214 -178.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . 0.433 ' O ' HG23 ' A' ' 477' ' ' VAL . 44.6 tt0 -103.31 131.94 49.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.817 0.341 . . . . 72.14 110.422 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . 0.498 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 43.2 tt0 -89.17 131.56 35.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.854 0.359 . . . . 73.5 110.164 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 98.78 -1.42 58.14 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.801 -0.714 . . . . 75.12 111.523 -176.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.505 ' HB3' HG22 ' A' ' 477' ' ' VAL . . . -79.57 112.01 16.41 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.055 0.455 . . . . 74.33 110.625 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -81.78 147.15 29.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.647 -0.706 . . . . 75.25 110.805 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 28.9 m -126.96 153.24 35.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.006 -0.543 . . . . 65.5 110.459 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -119.23 145.72 45.82 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.644 -0.502 . . . . 71.23 109.644 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -98.6 129.37 45.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.305 0.574 . . . . 74.51 110.909 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . 0.626 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 2.6 tm? -116.24 131.73 56.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.277 -0.874 . . . . 75.33 108.846 -177.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.429 ' HE3' ' HA3' ' A' ' 523' ' ' GLY . 1.2 tmtp? -120.55 107.32 12.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.898 0.38 . . . . 73.5 111.446 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 53.72 37.72 26.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.379 -0.828 . . . . 73.53 111.993 172.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.99 -24.04 33.01 Favored Glycine 0 CA--C 1.517 0.196 0 C-N-CA 120.751 -0.738 . . . . 63.14 112.553 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.9 t -97.28 127.87 49.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.725 0.298 . . . . 44.32 110.417 -178.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -86.65 131.85 34.04 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.82 -0.437 . . . . 72.51 109.82 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 3.3 pp -112.14 162.96 14.86 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.072 0.463 . . . . 71.33 111.256 -177.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 22.2 p -108.19 173.91 6.11 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.906 -0.588 . . . . 75.32 109.701 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . 0.63 ' HD3' ' CE2' ' A' ' 503' ' ' PHE . 13.9 tpt180 -80.9 -4.41 54.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.077 0.465 . . . . 75.13 110.467 -178.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -74.07 75.69 1.74 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.193 0.52 . . . . 75.13 110.48 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -145.47 170.7 15.87 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.824 -0.625 . . . . 74.41 109.482 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 15.2 t -68.65 172.12 6.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.086 0.47 . . . . 74.43 111.235 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -84.7 18.53 2.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 75.45 111.931 -172.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . 0.535 ' HZ2' ' CG ' ' A' ' 521' ' ' ASP . 13.8 tmtt? -58.09 -32.43 68.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.464 0.649 . . . . 72.11 109.785 174.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.61 ' HD2' HD11 ' A' ' 512' ' ' LEU . 23.0 p90 -144.44 144.11 31.23 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.467 -0.788 . . . . 72.44 109.153 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 22.2 p-90 -147.33 145.44 29.33 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.384 -0.371 . . . . 72.35 110.001 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . 0.63 ' CE2' ' HD3' ' A' ' 495' ' ' ARG . 44.9 p90 -126.87 151.99 47.64 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.327 -0.549 . . . . 64.32 111.651 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.618 ' HZ1' ' HB3' ' A' ' 504' ' ' LYS . 8.9 mtpm? -116.23 150.11 38.07 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.344 -0.844 . . . . 74.32 110.785 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.498 ' O ' ' HG3' ' A' ' 505' ' ' LYS . 18.5 ptpt -110.62 106.93 16.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.283 0.563 . . . . 74.54 109.804 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . 0.544 ' HB2' ' HG3' ' A' ' 509' ' ' ARG . 5.5 m-20 -113.82 80.3 1.36 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.23 0.538 . . . . 73.51 109.883 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.73 -96.7 0.38 Allowed Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.579 -0.737 . . . . 74.41 112.495 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . 0.498 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 19.2 pt20 -108.09 -10.83 15.39 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.918 0.39 . . . . 73.34 111.365 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.544 ' HG3' ' HB2' ' A' ' 506' ' ' ASP . 5.2 ptp180 -102.74 136.3 42.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.112 0.482 . . . . 74.25 110.528 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 -120.51 122.26 40.24 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.345 -0.613 . . . . 74.43 109.345 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . 0.493 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 12.8 m-70 -109.95 121.64 45.72 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 121.141 -0.223 . . . . 72.2 110.604 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.61 HD11 ' HD2' ' A' ' 501' ' ' TYR . 67.9 tp -106.93 110.62 22.82 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.45 -0.574 . . . . 74.51 109.45 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.41 ' N ' HD13 ' A' ' 513' ' ' ILE . 4.1 mp -100.84 119.85 49.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.238 -0.437 . . . . 75.52 110.145 -178.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.489 ' HB ' ' O ' ' A' ' 471' ' ' VAL . 69.0 mt -106.91 121.27 59.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.395 -0.594 . . . . 74.44 109.395 174.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -64.96 -51.65 60.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.172 -0.467 . . . . 74.03 110.227 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . 0.414 ' O ' ' HE2' ' A' ' 500' ' ' LYS . 42.0 mt-10 -139.39 129.7 25.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.986 -0.552 . . . . 75.44 110.157 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . 0.419 ' O ' HG13 ' A' ' 467' ' ' VAL . . . -64.04 132.44 50.57 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.966 -0.383 . . . . 71.11 109.966 175.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 49.7 ttm -128.6 171.85 11.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.926 -0.579 . . . . 75.24 109.625 -174.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 9.4 mp -54.87 -31.77 60.07 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.188 0.44 . . . . 73.34 112.188 -178.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -65.33 -21.45 66.7 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.485 0.55 . . . . 75.44 112.485 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . 0.535 ' CG ' ' HZ2' ' A' ' 500' ' ' LYS . 40.4 m-20 -75.39 -14.56 60.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.888 0.375 . . . . 72.31 110.938 -178.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -64.4 -20.97 66.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.2 -0.455 . . . . 53.23 109.935 173.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . 0.429 ' HA3' ' HE3' ' A' ' 488' ' ' LYS . . . -66.06 120.65 16.65 Favored Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 110.825 -0.91 . . . . 51.34 110.825 173.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -64.09 106.93 1.15 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.089 0.471 . . . . 64.33 110.956 -172.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . 0.409 ' HA ' ' O ' ' A' ' 487' ' ' LEU . 96.9 m-85 -75.09 135.03 41.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.416 -0.811 . . . . 75.44 111.459 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.626 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -126.07 139.57 53.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.559 -0.746 . . . . 75.15 109.678 175.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 37.5 tp -97.97 107.1 19.51 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.894 -0.409 . . . . 71.1 109.894 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 53.2 m -91.7 114.01 26.43 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.17 -0.468 . . . . 71.42 110.368 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 3.2 m -119.2 163.4 17.14 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.872 -0.604 . . . . 73.44 109.915 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 26.0 t -72.64 -5.29 36.42 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 111.769 0.285 . . . . 64.44 111.769 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -119.83 -105.7 2.11 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.562 -0.828 . . . . 75.25 111.701 177.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -91.02 124.24 7.47 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.902 -0.879 . . . . 75.52 110.902 174.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.13 141.57 28.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.952 0.406 . . . . 74.15 110.241 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -103.62 125.11 49.93 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.115 -0.493 . . . . 74.12 110.365 -178.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 5.2 tt -128.34 121.43 29.15 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.25 0.548 . . . . 74.23 110.294 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -135.0 141.26 46.17 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.458 -0.942 . . . . 74.42 108.458 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -96.43 109.7 22.19 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.044 0.926 . . . . 75.34 110.543 -174.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 54.8 tp -95.76 136.75 35.78 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.641 -1.163 . . . . 64.45 109.733 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.449 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 55.8 mt -126.08 118.87 52.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.992 -0.549 . . . . 72.31 109.649 177.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 40.9 t -114.44 105.41 18.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 109.699 -0.482 . . . . 74.44 109.699 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -87.36 139.29 30.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.852 -0.613 . . . . 75.31 110.864 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.47 155.99 20.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.456 -0.793 . . . . 73.52 110.679 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.411 ' HE3' ' HB3' ' A' ' 543' ' ' LYS . 26.3 mtpp . . . . . 0 C--O 1.248 1.011 0 CA-C-N 115.904 -0.589 . . . . 73.54 109.673 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . 0.462 ' O ' HD21 ' A' ' 455' ' ' LEU . 35.1 Cg_exo . . . . . 0 N--CA 1.466 -0.139 0 N-CA-C 110.931 -0.45 . . . . 73.52 110.931 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 56.5 t -65.98 113.32 2.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.932 -0.307 . . . . 75.12 110.341 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . 0.462 HD21 ' O ' ' A' ' 453' ' ' PRO . 2.6 mm? -78.62 125.22 29.07 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.113 -0.494 . . . . 72.23 111.084 -176.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 36.5 mm -81.96 106.34 12.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.064 -0.717 . . . . 64.34 109.064 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 86.1 m -62.02 -39.54 92.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.105 -0.498 . . . . 74.33 111.491 -175.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -128.63 121.84 21.36 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.445 -0.343 . . . . 73.22 110.532 -179.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.49 167.88 23.64 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.932 2.422 . . . . 70.4 112.398 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . 0.465 ' HB2' ' HB1' ' A' ' 536' ' ' ALA . 97.0 mt -80.89 147.38 30.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 74.44 110.586 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -55.67 122.25 10.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.451 -0.795 . . . . 64.15 111.721 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -93.18 -11.09 33.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.238 -0.892 . . . . 63.4 112.054 -176.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -88.05 157.42 18.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.473 0.654 . . . . 74.11 111.882 -169.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 9.0 tt -86.84 142.3 28.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.016 -0.993 . . . . 72.03 110.534 -173.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 27.7 m -130.18 178.17 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 CA-C-N 115.936 -0.575 . . . . 72.5 110.823 -178.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 21.0 ptp -127.24 160.28 31.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.965 0.412 . . . . 75.33 111.531 -178.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.63 146.25 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.188 -0.914 . . . . 74.24 112.45 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 102.02 -7.79 55.2 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 121.084 -0.579 . . . . 72.52 114.136 171.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -112.51 167.71 10.23 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 122.268 -0.548 . . . . 71.54 110.323 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.98 141.34 29.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.976 -0.749 . . . . 65.31 108.976 176.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.722 HG21 ' HB ' ' A' ' 514' ' ' ILE . 6.8 m -127.96 123.38 60.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 121.294 0.569 . . . . 54.01 110.01 176.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -121.93 123.96 42.94 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.303 0.573 . . . . 73.15 110.577 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -114.06 132.67 55.94 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.234 -0.894 . . . . 75.11 109.615 -175.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -120.32 116.91 26.47 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.46 -0.496 . . . . 73.12 110.669 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.648 ' O ' ' HB2' ' A' ' 510' ' ' HIS . 5.9 p -139.26 110.95 7.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.726 -0.67 . . . . 65.41 109.974 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.589 ' HB3' ' H ' ' A' ' 510' ' ' HIS . 0.6 OUTLIER -128.92 163.27 25.66 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.238 -0.437 . . . . 74.44 110.343 -178.644 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.498 HG23 ' HB1' ' A' ' 482' ' ' ALA . 17.7 m -113.67 171.91 3.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.25 -0.432 . . . . 72.21 110.874 -173.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 20.2 t -88.79 -22.28 23.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.043 -0.526 . . . . 70.45 110.854 -177.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -96.75 132.51 42.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.632 -0.507 . . . . 75.24 109.632 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . 0.645 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 11.4 pt-20 -87.47 137.54 32.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.108 0.48 . . . . 74.31 111.012 -175.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 95.58 -6.97 68.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.831 -0.699 . . . . 71.21 111.959 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.498 ' HB1' HG23 ' A' ' 477' ' ' VAL . . . -77.97 110.71 13.14 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.121 0.486 . . . . 74.3 110.187 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -92.8 164.88 13.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.822 -0.626 . . . . 70.44 110.508 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.473 HG12 HG23 ' A' ' 529' ' ' THR . 35.5 m -135.95 154.82 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.208 -0.451 . . . . 71.31 110.345 -178.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -117.42 138.71 51.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.769 -0.456 . . . . 74.5 109.769 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . 0.528 ' HB2' HD21 ' A' ' 493' ' ' LEU . 87.6 m95 -99.34 138.12 36.87 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.045 0.45 . . . . 72.0 111.217 -176.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . 0.597 ' HB3' ' HB2' ' A' ' 526' ' ' ALA . 34.5 tp -121.84 128.99 52.27 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.259 -0.645 . . . . 74.55 109.259 176.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -112.36 106.68 15.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.004 0.431 . . . . 74.53 110.909 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.1 t70 53.63 36.82 24.56 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.447 -0.797 . . . . 73.34 111.625 174.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 94.15 -21.02 44.49 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.771 -0.728 . . . . 72.04 112.669 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 61.6 t -99.77 133.07 43.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 110.099 -0.334 . . . . 74.32 110.099 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -78.81 125.61 29.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.868 -0.79 . . . . 74.34 108.868 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.528 HD21 ' HB2' ' A' ' 486' ' ' TRP . 3.2 pp -68.73 161.82 27.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.382 0.61 . . . . 73.22 112.098 -170.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 6.6 t -107.4 172.88 6.58 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.126 -0.943 . . . . 64.51 110.903 -172.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -104.64 7.62 35.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.224 0.535 . . . . 75.11 110.274 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -62.11 -69.44 0.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.876 -0.602 . . . . 73.33 111.417 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . 0.521 ' OE2' ' HB2' ' A' ' 500' ' ' LYS . 25.7 tt0 -106.68 118.89 37.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.116 0.484 . . . . 72.32 110.477 178.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' THR . . . . . 0.585 HG21 ' HB3' ' A' ' 502' ' ' TRP . 3.9 m -111.27 11.69 21.7 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.629 0.728 . . . . 74.41 109.686 175.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . 0.438 ' H ' ' HG2' ' A' ' 497' ' ' GLU . 89.3 m-85 -83.81 -25.51 30.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.639 -0.71 . . . . 75.02 111.249 -176.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . 0.691 ' HB2' ' HZ1' ' A' ' 500' ' ' LYS . 4.6 ttmp? -69.69 -42.43 74.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.113 0.483 . . . . 72.44 110.017 177.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.482 ' CB ' HG12 ' A' ' 514' ' ' ILE . 7.5 p90 -159.0 142.2 14.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.499 -0.773 . . . . 65.24 110.164 -178.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 502' ' ' TRP . . . . . 0.585 ' HB3' HG21 ' A' ' 498' ' ' THR . 0.1 OUTLIER -140.78 145.59 36.55 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.201 -0.454 . . . . 75.4 110.991 178.478 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . 0.478 ' HB3' HD13 ' A' ' 512' ' ' LEU . 31.2 p90 -117.77 151.69 36.8 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.21 -0.45 . . . . 74.25 109.925 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -115.52 135.44 54.09 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.981 -0.554 . . . . 73.14 109.787 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 1.9 pptp? -104.49 132.71 50.42 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.856 -0.424 . . . . 72.52 109.856 172.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . 0.665 ' HB3' ' HB2' ' A' ' 509' ' ' ARG . 8.0 t70 -143.2 84.38 1.82 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.168 -0.469 . . . . 73.31 109.865 -177.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.31 -97.61 0.34 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.032 -0.604 . . . . 74.15 111.854 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . 0.645 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 19.1 pt20 -105.55 -7.69 18.46 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.328 0.585 . . . . 73.24 110.315 176.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.665 ' HB2' ' HB3' ' A' ' 506' ' ' ASP . 58.2 mtt180 -84.66 139.87 31.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.415 -0.811 . . . . 73.41 110.807 -175.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . 0.648 ' HB2' ' O ' ' A' ' 475' ' ' CYS . 95.2 m-70 -141.77 116.99 10.07 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.414 -0.587 . . . . 73.14 109.414 174.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 19.8 m-70 -125.75 122.88 37.5 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.93 -0.396 . . . . 75.35 109.93 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.478 HD13 ' HB3' ' A' ' 503' ' ' PHE . 54.0 tp -107.39 120.14 41.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.861 0.362 . . . . 54.43 110.513 -176.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 60.5 mt -115.06 114.51 46.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 116.504 -0.316 . . . . 61.33 110.556 -178.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.722 ' HB ' HG21 ' A' ' 471' ' ' VAL . 58.5 mt -100.59 119.86 49.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.196 0.522 . . . . 75.13 109.598 176.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -70.75 -37.71 73.44 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.359 -0.837 . . . . 64.45 111.935 -173.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -138.63 111.07 7.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.598 -0.274 . . . . 74.32 111.296 -177.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -67.29 122.35 17.69 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.679 -0.489 . . . . 64.43 109.679 173.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 93.9 mmm -135.04 175.21 9.79 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.886 -0.597 . . . . 74.31 110.548 -174.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.83 -33.76 74.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.858 0.361 . . . . 72.4 110.77 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -62.85 -26.56 68.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.224 0.535 . . . . 73.23 111.071 173.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -83.2 -14.89 52.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.423 -0.808 . . . . 73.35 110.151 -177.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -76.31 5.61 6.79 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.795 -0.638 . . . . 52.42 111.202 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -70.64 158.14 53.61 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.908 -0.663 . . . . 75.12 111.607 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -83.3 114.16 21.21 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 122.048 -0.678 . . . . 72.1 109.999 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -88.37 132.97 34.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.149 0.5 . . . . 74.21 111.503 -174.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.597 ' HB2' ' HB3' ' A' ' 487' ' ' LEU . . . -122.69 142.92 50.16 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.607 -0.724 . . . . 73.21 109.702 175.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.685 ' HB3' ' HB2' ' A' ' 534' ' ' ALA . 10.0 tt -121.13 117.92 28.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.986 0.422 . . . . 62.45 109.999 -176.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 55.9 m -99.23 124.02 43.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.01 -0.541 . . . . 72.21 110.482 -179.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.473 HG23 HG12 ' A' ' 484' ' ' VAL . 2.3 m -113.78 166.13 11.86 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.168 -0.308 . . . . 74.44 110.168 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 9.5 m -54.83 -36.32 64.89 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.807 0.337 . . . . 73.2 111.83 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -136.43 -6.77 1.79 Allowed Glycine 0 C--O 1.227 -0.304 0 C-N-CA 120.476 -0.869 . . . . 74.33 112.716 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . 0.402 ' H ' ' HB ' ' A' ' 529' ' ' THR . . . -115.34 173.27 14.64 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.828 -0.701 . . . . 73.45 112.266 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -146.68 137.63 24.08 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.917 -0.401 . . . . 74.55 109.917 177.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . 0.685 ' HB2' ' HB3' ' A' ' 527' ' ' LEU . . . -132.65 148.55 52.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.405 -0.361 . . . . 73.1 110.501 178.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 7.7 tt -144.62 131.28 20.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.609 -0.886 . . . . 74.53 108.609 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 460' ' ' LEU . . . -135.13 137.44 42.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.157 0.503 . . . . 72.54 110.757 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -99.68 109.09 21.58 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.994 -0.548 . . . . 75.03 109.846 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 52.7 tp -104.23 115.87 31.18 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.731 -0.668 . . . . 70.04 109.792 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.421 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 54.6 mt -105.65 112.37 38.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 109.769 -0.456 . . . . 74.24 109.769 177.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 36.3 t -102.97 102.37 13.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 116.043 -0.526 . . . . 71.51 109.75 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -85.36 145.74 27.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.029 -0.532 . . . . 73.42 111.145 -176.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -81.05 153.77 27.2 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.313 -0.625 . . . . 74.2 109.313 172.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.337 -0.839 . . . . 75.23 110.085 -178.099 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo . . . . . 0 N--CA 1.463 -0.291 0 CA-C-O 120.881 0.284 . . . . 70.4 111.701 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.69 114.72 3.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.199 -0.455 . . . . 74.54 110.275 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 93.4 mt -78.98 142.95 36.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.856 -0.611 . . . . 71.22 110.995 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . 0.415 HD12 HG13 ' A' ' 477' ' ' VAL . 31.0 mm -96.84 119.24 44.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.617 -0.72 . . . . 43.22 109.93 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 31.6 p -92.45 -31.7 15.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.022 0.439 . . . . 74.31 111.597 -178.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.722 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 18.5 mmt180 -101.18 121.63 51.28 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.284 -0.417 . . . . 74.5 110.638 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -86.78 161.27 9.11 Favored 'Trans proline' 0 N--CA 1.45 -1.049 0 C-N-CA 122.077 1.851 . . . . 70.13 112.176 175.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -83.3 172.32 12.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.008 -0.542 . . . . 74.45 110.062 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . 0.847 ' HG3' HD13 ' A' ' 538' ' ' LEU . 4.7 pm0 -56.99 118.21 4.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.818 0.818 . . . . 73.14 112.856 -172.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -95.28 -19.1 20.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.48 -0.782 . . . . 75.03 110.302 172.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -92.16 154.72 18.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 75.23 111.605 -174.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.709 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 3.2 tt -90.12 134.86 34.01 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.021 -0.733 . . . . 73.03 109.021 176.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.536 ' N ' HD23 ' A' ' 464' ' ' LEU . 35.8 m -120.8 160.98 21.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.176 0.513 . . . . 73.41 111.778 -174.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' MET . . . . . 0.427 ' SD ' ' HD3' ' A' ' 543' ' ' LYS . 23.1 ptp -98.85 153.37 18.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 75.11 110.582 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . 0.447 ' CG1' ' HA ' ' A' ' 542' ' ' GLU . 14.3 p -69.01 145.21 13.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 74.04 111.246 177.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 100.5 -24.74 30.92 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.778 -0.725 . . . . 45.35 113.7 172.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -85.81 162.0 18.86 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 117.191 0.496 . . . . 71.12 110.916 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -86.27 116.8 24.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.962 -0.563 . . . . 73.14 109.778 176.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 22.0 t -117.23 126.74 74.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 110.037 -0.357 . . . . 71.22 110.037 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.488 ' HG2' HG21 ' A' ' 513' ' ' ILE . 41.2 mt-10 -109.07 123.47 49.22 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.447 -0.342 . . . . 74.03 110.201 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.583 ' CE1' ' HB3' ' A' ' 461' ' ' GLU . 25.3 m-85 -106.85 109.08 20.89 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.415 -0.587 . . . . 73.44 109.415 177.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . 0.414 ' O ' ' HB3' ' A' ' 458' ' ' ARG . 29.5 mt-10 -106.58 116.73 32.44 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.701 -0.481 . . . . 73.44 109.701 -178.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.722 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 36.8 t -135.69 111.81 9.65 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.227 0.537 . . . . 75.44 110.07 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.605 ' HB3' ' H ' ' A' ' 510' ' ' HIS . 7.3 pt-20 -131.05 167.67 18.69 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.776 -0.647 . . . . 75.21 109.897 -176.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.54 HG23 ' HB3' ' A' ' 482' ' ' ALA . 20.9 m -115.06 166.94 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.932 0.396 . . . . 75.13 111.59 -172.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 41.2 t -86.34 -11.08 53.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.73 -0.668 . . . . 74.15 111.695 -176.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -116.22 139.72 50.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.903 0.382 . . . . 71.01 111.208 -175.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . 0.619 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 7.7 tp10 -75.49 146.83 40.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.65 -0.705 . . . . 74.12 110.79 -177.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 82.43 -8.76 60.58 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 116.018 -0.537 . . . . 73.04 112.977 177.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.54 ' HB3' HG23 ' A' ' 477' ' ' VAL . . . -74.72 116.26 15.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.418 0.627 . . . . 71.2 111.484 -176.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -82.31 156.05 24.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.115 -0.948 . . . . 75.42 110.327 178.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 26.8 m -129.27 154.36 40.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.322 -0.399 . . . . 73.41 110.726 -178.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . 0.505 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 57.3 tttp -118.49 134.93 54.69 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.871 -0.604 . . . . 64.53 110.076 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -98.23 122.06 40.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.069 0.461 . . . . 64.32 110.582 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 24.4 tp -120.12 125.35 48.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.654 -0.703 . . . . 64.52 109.53 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.532 ' HD2' HD23 ' A' ' 493' ' ' LEU . 26.1 tttp -101.65 103.65 14.46 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.762 -0.458 . . . . 64.23 109.762 -177.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.6 t0 45.81 38.23 4.16 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.781 0.832 . . . . 73.33 112.518 -179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 93.02 -4.75 75.17 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.542 -0.837 . . . . 60.41 112.711 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 54.3 t -99.85 127.32 52.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.947 -0.39 . . . . 71.21 109.947 176.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -72.95 124.56 25.69 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.066 -0.515 . . . . 73.11 110.598 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . 0.532 HD23 ' HD2' ' A' ' 488' ' ' LYS . 86.0 mt -76.49 148.54 37.11 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.135 -0.484 . . . . 75.45 110.787 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 7.8 t -93.48 165.47 12.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.901 -0.59 . . . . 73.51 110.771 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -65.61 -29.07 69.61 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.061 0.458 . . . . 73.51 110.677 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -108.77 80.77 1.37 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.3 0.572 . . . . 74.24 110.506 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -96.52 161.32 13.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.354 -0.839 . . . . 73.52 109.888 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 11.2 t -63.29 151.86 39.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.058 0.456 . . . . 62.3 110.962 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -85.23 16.97 3.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.098 -0.501 . . . . 75.35 111.12 -176.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . 0.683 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 33.3 tttp -71.66 -28.06 63.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.482 -0.562 . . . . 74.34 109.482 177.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.532 ' HB3' HG22 ' A' ' 514' ' ' ILE . 2.2 p90 -142.82 135.01 27.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.661 -0.7 . . . . 75.3 110.101 173.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 502' ' ' TRP . . . . . 0.467 ' CZ3' ' HE3' ' A' ' 504' ' ' LYS . 11.4 p-90 -139.17 166.51 24.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.513 -0.767 . . . . 75.02 109.705 -172.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -133.58 157.46 45.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.438 0.637 . . . . 73.41 112.403 -175.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.467 ' HE3' ' CZ3' ' A' ' 502' ' ' TRP . 99.7 mttt -118.21 150.73 38.93 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.549 -1.205 . . . . 73.33 108.913 174.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.4 pptp? -137.94 129.87 28.59 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.348 0.594 . . . . 73.31 111.208 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . 0.637 ' HB2' ' HB2' ' A' ' 509' ' ' ARG . 26.9 m-20 -119.56 79.5 1.44 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.58 -0.896 . . . . 54.54 108.58 173.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 60.33 -104.44 0.62 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.92 -0.657 . . . . 74.53 112.402 -175.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . 0.619 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 20.7 pt20 -80.39 -16.38 54.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.995 0.426 . . . . 75.12 110.734 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.637 ' HB2' ' HB2' ' A' ' 506' ' ' ASP . 84.8 mtt180 -84.71 132.02 34.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.126 -0.488 . . . . 75.4 110.12 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . 0.605 ' H ' ' HB3' ' A' ' 476' ' ' GLU . 77.9 m-70 -136.14 117.11 14.25 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.38 -0.6 . . . . 72.44 109.38 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -125.63 121.71 34.32 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 121.034 -0.266 . . . . 62.41 110.498 -175.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . 0.402 ' HB3' ' O ' ' A' ' 473' ' ' PHE . 37.7 tp -103.61 133.11 49.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.717 0.294 . . . . 64.53 110.435 -178.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.488 HG21 ' HG2' ' A' ' 472' ' ' GLU . 4.7 mp -121.19 116.85 50.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 110.083 -0.34 . . . . 62.22 110.083 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.532 HG22 ' HB3' ' A' ' 501' ' ' TYR . 46.9 mt -97.49 120.56 46.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.399 -0.593 . . . . 75.41 109.399 175.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -69.06 -41.06 78.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.006 0.432 . . . . 75.15 110.483 -177.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . 0.683 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 34.2 mt-10 -137.47 107.95 6.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.94 -0.573 . . . . 73.42 110.407 -178.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -65.26 122.59 17.46 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.264 -0.643 . . . . 64.03 109.264 174.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 518' ' ' MET . . . . . 0.455 ' HG3' ' HG2' ' A' ' 520' ' ' GLU . 11.9 tpt -125.83 157.1 38.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.667 0.27 . . . . 75.43 110.858 -172.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.93 -38.14 84.76 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.231 -0.441 . . . . 74.41 111.397 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . 0.455 ' HG2' ' HG3' ' A' ' 518' ' ' MET . 10.4 pt-20 -70.15 -22.35 62.99 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.222 0.534 . . . . 75.3 110.832 178.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -88.09 -13.29 41.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.707 -0.679 . . . . 73.43 110.392 -176.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.475 ' HB1' ' HB ' ' A' ' 540' ' ' VAL . . . -63.0 6.19 0.11 Allowed 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.723 1.009 . . . . 74.24 113.723 -174.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -59.67 137.03 50.01 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.273 -0.731 . . . . 72.15 111.273 175.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -60.94 126.48 27.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.356 -0.238 . . . . 70.44 110.356 -175.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -84.95 131.15 34.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.83 0.824 . . . . 74.31 112.19 -174.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.1 135.79 48.62 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.765 -1.107 . . . . 65.13 109.837 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 9.9 tt -122.32 122.99 40.36 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.68 -0.489 . . . . 61.31 109.68 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . 0.505 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 57.6 m -103.61 124.55 49.02 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.983 -0.553 . . . . 75.52 110.598 -177.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.493 HG21 HG11 ' A' ' 477' ' ' VAL . 14.3 m -117.56 166.59 12.2 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.344 -0.613 . . . . 74.31 109.344 176.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 22.9 t -66.68 -11.24 53.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.82 0.343 . . . . 72.14 110.699 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -99.52 -83.6 1.74 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.0 -0.619 . . . . 71.44 112.05 177.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -114.02 166.96 12.2 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.7 -0.762 . . . . 63.23 112.24 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -109.92 122.71 48.18 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.802 -0.444 . . . . 64.5 109.802 177.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -103.2 135.12 45.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.46 -0.336 . . . . 74.25 110.431 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 8.3 tt -146.05 136.69 24.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.892 -0.41 . . . . 71.53 109.892 -178.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -143.5 155.27 44.29 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.278 -0.419 . . . . 72.44 109.945 178.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -96.54 112.06 23.95 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.4 0.619 . . . . 70.02 111.225 -177.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.847 HD13 ' HG3' ' A' ' 461' ' ' GLU . 62.8 tp -94.52 136.45 34.81 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.668 -0.697 . . . . 65.41 110.115 177.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.709 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 65.3 mt -133.15 134.03 57.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.848 -0.797 . . . . 75.01 108.848 175.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.475 ' HB ' ' HB1' ' A' ' 522' ' ' ALA . 98.4 t -122.84 116.28 48.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 110.021 -0.362 . . . . 71.03 110.021 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . 0.524 ' HG3' HD22 ' A' ' 464' ' ' LEU . 43.7 mt-30 -94.34 140.58 29.62 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.25 -0.432 . . . . 74.2 110.758 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . 0.447 ' HA ' ' CG1' ' A' ' 467' ' ' VAL . 41.9 tt0 -75.0 141.26 43.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.534 -0.757 . . . . 70.2 109.541 175.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . 0.427 ' HD3' ' SD ' ' A' ' 466' ' ' MET . 54.4 mtmt . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.13 -0.938 . . . . 75.04 109.512 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.455 -0.754 0 CA-C-O 120.857 0.274 . . . . 73.23 111.424 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 454' ' ' VAL . . . . . 0.427 HG13 ' HB ' ' A' ' 477' ' ' VAL . 19.6 t -74.9 111.26 10.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.59 -0.522 . . . . 72.02 109.59 178.064 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 90.6 mt -97.6 164.06 12.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.924 -0.58 . . . . 73.22 110.901 -175.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' ILE . . . . . 0.455 HD13 HG11 ' A' ' 477' ' ' VAL . 48.4 mm -96.87 115.06 35.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.838 -0.619 . . . . 63.45 110.193 -178.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 33.7 m -85.69 -35.61 20.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.145 0.498 . . . . 65.41 110.823 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 458' ' ' ARG . . . . . 0.804 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 5.7 mmp_? -108.52 108.14 60.71 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.094 -0.503 . . . . 71.14 110.362 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_exo -70.78 155.63 62.21 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.405 2.07 . . . . 72.2 111.436 176.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.11 162.7 23.59 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.774 -0.454 . . . . 74.2 109.774 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -69.91 121.04 16.56 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.487 0.661 . . . . 61.4 111.444 -173.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -92.22 -11.65 34.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.993 -1.003 . . . . 73.51 111.711 -176.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -87.56 156.01 19.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.127 0.489 . . . . 74.11 110.925 -170.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.66 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 6.0 tt -88.55 136.61 32.9 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.363 -0.835 . . . . 74.15 109.679 -171.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' VAL . . . . . 0.488 ' N ' HD22 ' A' ' 464' ' ' LEU . 30.6 m -120.97 172.25 8.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.269 0.557 . . . . 70.24 111.655 -173.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' MET . . . . . 0.575 ' H ' ' NE2' ' A' ' 469' ' ' GLN . 66.5 mtt -116.62 163.52 15.98 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.795 -0.639 . . . . 74.3 109.964 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 48.6 t -65.04 131.02 30.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.338 -0.392 . . . . 72.12 111.185 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.14 -14.32 58.43 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.818 -0.706 . . . . 74.51 114.602 171.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.575 ' NE2' ' H ' ' A' ' 466' ' ' MET . 9.6 pt20 -83.17 149.42 26.86 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.923 0.862 . . . . 71.11 110.637 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 44.8 ttt180 -73.6 116.1 13.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.524 -0.762 . . . . 71.21 110.567 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 95.0 t -120.86 123.38 70.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.792 -0.64 . . . . 75.53 109.859 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -133.92 140.79 47.02 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.185 0.517 . . . . 74.52 110.172 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.531 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 90.5 m-85 -105.99 124.8 50.15 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.854 -0.612 . . . . 73.51 110.786 -175.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -97.63 117.73 32.57 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.969 -1.123 . . . . 74.13 107.969 176.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' CYS . . . . . 0.804 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 6.4 p -140.23 119.04 12.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.184 0.516 . . . . 73.1 111.699 -175.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.599 ' HG2' ' CG ' ' A' ' 458' ' ' ARG . 10.1 pt-20 -131.05 148.81 52.79 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.005 -0.739 . . . . 74.35 109.005 175.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' VAL . . . . . 0.474 HG21 ' HB1' ' A' ' 482' ' ' ALA . 18.3 m -111.19 164.38 7.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 116.238 -0.437 . . . . 73.13 110.859 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 53.5 p -65.67 -25.89 67.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.032 -0.531 . . . . 75.42 112.403 -174.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -106.87 133.7 51.13 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.912 -0.315 . . . . 70.34 110.786 -174.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' GLU . . . . . 0.669 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 10.0 tp10 -73.36 147.4 44.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.086 -0.506 . . . . 74.43 110.673 -178.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 61.27 34.45 88.2 Favored Glycine 0 N--CA 1.453 -0.221 0 CA-C-N 115.898 -0.592 . . . . 74.25 112.82 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . 0.474 ' HB1' HG21 ' A' ' 477' ' ' VAL . . . -95.19 154.45 17.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.006 0.432 . . . . 73.5 111.062 -178.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -100.77 133.11 45.72 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.75 -0.659 . . . . 74.43 110.647 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . 0.494 ' HB ' HD22 ' A' ' 527' ' ' LEU . 32.5 m -124.15 144.24 34.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.931 -0.577 . . . . 72.32 109.547 175.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -126.96 141.04 51.9 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.751 0.31 . . . . 65.14 110.292 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -98.3 137.35 37.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.086 -0.507 . . . . 73.44 111.074 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 55.6 tp -134.21 118.78 18.0 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.747 -0.835 . . . . 75.54 108.747 173.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' LYS . . . . . 0.45 ' HD3' ' C ' ' A' ' 488' ' ' LYS . 14.1 tmtt? -109.52 106.2 15.83 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.703 -0.399 . . . . 72.3 110.518 -176.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 2.5 t70 48.66 38.74 12.08 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.333 -0.849 . . . . 73.23 112.015 173.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.62 -16.01 60.26 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.79 -0.719 . . . . 74.34 113.001 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 47.4 t -104.72 122.23 57.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.741 0.305 . . . . 72.11 110.427 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -81.46 133.94 35.47 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.765 -0.457 . . . . 65.13 109.765 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 69.4 mt -74.99 152.89 38.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.104 -0.498 . . . . 65.33 111.114 -175.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' THR . . . . . 0.62 HG23 ' H ' ' A' ' 496' ' ' GLU . 4.8 m -91.2 141.51 28.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.029 -0.532 . . . . 64.54 110.937 -175.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -83.13 -6.2 59.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.23 0.538 . . . . 74.23 110.539 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' GLU . . . . . 0.62 ' H ' HG23 ' A' ' 494' ' ' THR . 7.6 pt-20 -130.35 34.72 4.15 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.554 -0.748 . . . . 74.32 109.763 178.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' GLU . . . . . 0.56 ' HB2' ' HB ' ' A' ' 494' ' ' THR . 7.1 tp10 -71.93 170.71 13.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.315 -0.857 . . . . 71.42 110.782 -176.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' THR . . . . . 0.402 ' H ' ' HG3' ' A' ' 497' ' ' GLU . 8.9 t -68.58 -176.7 0.83 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.119 -0.491 . . . . 74.22 110.837 175.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -78.99 17.1 0.79 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.456 -0.338 . . . . 75.11 111.853 -174.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -61.87 -45.96 91.48 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.908 -0.775 . . . . 75.54 108.908 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' TYR . . . . . 0.529 ' HB3' HG12 ' A' ' 514' ' ' ILE . 10.1 p90 -143.04 143.39 31.86 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.054 -0.976 . . . . 73.24 109.52 176.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 35.9 p-90 -135.91 145.34 46.18 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.865 -0.42 . . . . 75.13 109.865 176.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 503' ' ' PHE . . . . . 0.466 ' HA ' ' O ' ' A' ' 511' ' ' HIS . 44.6 p90 -114.86 140.9 48.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.592 0.711 . . . . 71.45 111.818 -175.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 504' ' ' LYS . . . . . 0.45 ' HB3' ' HB2' ' A' ' 511' ' ' HIS . 24.1 tptm -116.31 114.18 23.99 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.802 -1.09 . . . . 75.13 109.137 176.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.487 ' O ' ' HD3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -112.37 138.37 49.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.06 0.457 . . . . 72.51 112.192 -176.169 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -149.59 85.41 1.44 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.836 -0.62 . . . . 64.32 109.855 170.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 69.5 -116.68 7.18 Favored Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 115.614 -0.721 . . . . 61.25 112.777 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 508' ' ' GLN . . . . . 0.669 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 4.1 pt20 -76.98 -25.95 53.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.708 0.29 . . . . 74.13 111.508 -177.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -99.12 127.0 44.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.374 0.606 . . . . 71.14 111.448 -174.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -129.39 155.96 44.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.477 -0.783 . . . . 70.44 109.705 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 511' ' ' HIS . . . . . 0.466 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 80.4 m-70 -138.9 124.58 19.62 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.897 -0.408 . . . . 73.23 109.897 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 56.9 tp -111.46 106.09 14.89 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.929 -0.397 . . . . 75.42 109.929 176.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 513' ' ' ILE . . . . . 0.401 ' N ' HD13 ' A' ' 513' ' ' ILE . 4.5 mp -103.25 118.41 50.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.06 0.457 . . . . 71.31 111.018 -176.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 514' ' ' ILE . . . . . 0.529 HG12 ' HB3' ' A' ' 501' ' ' TYR . 62.2 mt -101.9 121.76 53.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.145 -0.687 . . . . 74.25 109.145 174.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -64.14 -51.41 64.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.267 -0.424 . . . . 74.13 111.396 -174.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -133.01 114.87 14.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.342 -0.39 . . . . 73.2 110.151 175.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . 0.499 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -62.69 127.53 31.7 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.695 -0.483 . . . . 75.12 109.695 173.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 28.6 ttm -132.58 173.68 11.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.976 -0.379 . . . . 74.31 109.976 -174.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -53.43 -36.63 61.76 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.606 0.595 . . . . 74.01 112.606 -172.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 520' ' ' GLU . . . . . 0.413 ' H ' ' CD ' ' A' ' 520' ' ' GLU . 1.8 mp0 -58.92 -35.02 72.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.948 0.404 . . . . 74.14 110.895 -178.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 521' ' ' ASP . . . . . 0.422 ' C ' ' H ' ' A' ' 523' ' ' GLY . 32.8 m-20 -74.43 -13.52 60.72 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.995 -0.548 . . . . 73.43 112.223 -169.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 522' ' ' ALA . . . . . 0.555 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -63.78 7.33 0.12 Allowed 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.911 1.078 . . . . 72.33 113.911 -175.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 523' ' ' GLY . . . . . 0.422 ' H ' ' C ' ' A' ' 521' ' ' ASP . . . -86.63 169.3 40.82 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.987 -0.625 . . . . 72.14 112.443 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -73.97 119.84 18.74 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 122.717 -0.284 . . . . 74.51 110.804 -178.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -86.43 135.0 33.66 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.765 0.317 . . . . 72.2 110.804 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.4 134.63 47.28 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.062 0.458 . . . . 72.32 110.475 175.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 527' ' ' LEU . . . . . 0.494 HD22 ' HB ' ' A' ' 484' ' ' VAL . 7.5 tt -118.04 111.85 19.46 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.053 -0.721 . . . . 73.44 109.053 177.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 43.9 t -99.24 128.1 45.32 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.926 0.393 . . . . 72.41 110.593 -177.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 529' ' ' THR . . . . . 0.464 HG21 HG12 ' A' ' 477' ' ' VAL . 1.8 m -117.88 175.47 5.65 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.892 -0.594 . . . . 75.33 109.45 176.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 9.1 m -58.52 -24.36 60.38 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.014 0.375 . . . . 44.43 112.014 178.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -112.28 -88.38 1.76 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.637 -0.792 . . . . 73.35 112.21 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -94.18 -172.25 38.58 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.819 -0.705 . . . . 62.33 112.016 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -145.49 147.55 32.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.005 0.431 . . . . 74.02 110.725 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 534' ' ' ALA . . . . . 0.415 ' HB3' HG23 ' A' ' 456' ' ' ILE . . . -105.75 118.71 37.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.007 -0.542 . . . . 75.33 110.115 178.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 7.5 tt -114.99 124.72 52.4 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.441 -0.577 . . . . 74.5 109.441 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -148.36 149.11 31.2 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.985 -0.552 . . . . 74.2 109.809 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -116.77 112.92 21.83 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.372 0.606 . . . . 72.23 111.052 -177.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . 0.555 ' O ' ' HA ' ' A' ' 522' ' ' ALA . 31.3 tp -96.92 111.5 23.68 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.298 -0.864 . . . . 73.15 109.462 -179.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 539' ' ' ILE . . . . . 0.66 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 63.3 mt -97.47 129.11 48.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 110.129 -0.323 . . . . 73.12 110.129 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 34.7 t -111.54 116.47 52.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 61.42 110.601 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 541' ' ' GLN . . . . . 0.542 ' HG3' HD21 ' A' ' 464' ' ' LEU . 98.4 mt-30 -99.61 155.44 17.6 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.085 0.469 . . . . 75.34 111.173 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -80.56 149.75 29.82 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.615 -0.721 . . . . 74.22 110.654 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.723 -0.656 . . . . 73.42 110.157 -179.756 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.651 0 N-CA-C 111.501 -0.64 . . . . 64.41 111.501 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 2.7 p -74.87 137.21 41.62 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.861 0.363 . . . . 75.34 110.058 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 17.4 p-80 -89.45 59.44 4.8 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.373 0.606 . . . . 74.41 110.642 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 24.5 mmt -100.41 106.54 43.19 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.515 -0.766 . . . . 73.23 109.539 177.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -71.06 140.1 37.12 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.728 2.285 . . . . 62.32 111.537 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 48.2 t -66.34 115.83 4.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.623 -0.51 . . . . 72.43 109.623 176.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -78.59 143.57 36.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.172 -0.467 . . . . 62.42 110.884 -174.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . 0.495 HG22 ' HB1' ' A' ' 534' ' ' ALA . 37.8 mm -95.49 110.77 24.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.356 -0.609 . . . . 73.44 109.356 175.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' THR . . . . . 0.416 ' HB ' ' HG3' ' A' ' 476' ' ' GLU . 16.5 m -67.99 -40.91 82.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.019 0.438 . . . . 74.13 111.318 -175.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.701 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 19.5 mmt85 -116.67 120.39 34.43 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.152 -0.476 . . . . 64.1 110.472 -176.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -76.12 165.53 29.48 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 121.935 1.757 . . . . 71.33 110.45 170.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.435 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 3.7 mm? -80.43 149.03 30.29 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.647 -0.421 . . . . 65.14 109.98 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 23.5 mp0 -52.62 119.38 4.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.267 -0.879 . . . . 63.44 111.999 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -92.01 -11.24 36.53 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.819 -1.082 . . . . 72.24 112.154 -176.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -88.69 155.12 19.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.166 0.508 . . . . 70.21 111.139 -172.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 9.4 tt -87.81 136.14 33.08 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.624 -0.716 . . . . 73.44 109.751 -174.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 35.7 m -121.44 175.65 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.987 -0.552 . . . . 75.34 110.937 -176.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' MET . . . . . 0.438 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 25.2 ptt? -120.85 152.25 38.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.199 -0.455 . . . . 72.33 111.077 -176.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 69.3 t -61.55 139.33 20.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.463 -0.79 . . . . 73.23 111.244 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.35 -18.34 54.01 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.76 -0.733 . . . . 72.3 114.105 173.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 466' ' ' MET . 9.7 pt20 -94.33 155.47 16.98 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 117.836 0.818 . . . . 75.12 110.953 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . 0.497 ' HG3' ' HA ' ' A' ' 515' ' ' ASN . 42.6 ttm180 -88.02 116.0 25.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.787 -0.642 . . . . 73.23 109.832 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 10.4 t -112.78 127.6 69.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.987 0.422 . . . . 65.52 110.877 -175.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -104.59 123.63 47.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.774 -0.648 . . . . 73.12 110.048 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.582 ' HE2' HD11 ' A' ' 514' ' ' ILE . 67.5 m-85 -107.39 134.34 50.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.209 -0.45 . . . . 72.43 109.941 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -122.96 118.43 27.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.03 0.443 . . . . 74.14 111.37 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.701 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 23.0 t -143.08 113.56 7.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.743 -0.662 . . . . 74.32 109.539 176.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.67 ' HB2' ' HA ' ' A' ' 509' ' ' ARG . 13.0 pt-20 -133.51 166.42 22.61 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.291 -0.413 . . . . 75.15 110.841 -177.01 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.516 HG22 ' HB3' ' A' ' 482' ' ' ALA . 6.7 m -101.09 159.56 3.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.757 -0.656 . . . . 72.1 110.505 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 22.2 t -80.79 -2.28 46.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.151 -0.477 . . . . 73.34 111.227 -176.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -134.17 132.8 40.23 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.691 -0.485 . . . . 65.14 109.691 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -78.94 153.02 30.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.179 0.514 . . . . 73.44 112.007 -173.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 95.62 -16.85 60.42 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.52 -0.763 . . . . 61.41 112.359 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.516 ' HB3' HG22 ' A' ' 477' ' ' VAL . . . -82.77 132.84 35.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.199 0.523 . . . . 72.43 111.521 -177.165 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -105.15 165.13 11.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.507 -0.769 . . . . 65.31 110.189 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.489 HG21 HD13 ' A' ' 527' ' ' LEU . 27.3 m -137.0 173.22 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.39 -0.368 . . . . 71.24 110.997 -174.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -117.44 140.32 49.74 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.08 -0.509 . . . . 65.24 109.649 174.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -98.71 124.05 43.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.152 0.501 . . . . 75.41 110.445 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . 0.406 ' HB3' ' HB2' ' A' ' 526' ' ' ALA . 53.2 tp -115.68 119.21 35.33 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.032 -0.729 . . . . 75.32 109.032 177.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.414 ' HE2' ' HA3' ' A' ' 523' ' ' GLY . 14.0 tmtt? -121.17 113.05 19.44 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.348 -0.387 . . . . 75.2 110.778 -175.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . 0.454 ' HB2' ' HA3' ' A' ' 523' ' ' GLY . 35.1 t0 55.22 37.92 29.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.483 -0.78 . . . . 70.41 111.43 173.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 85.03 -4.13 86.02 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.731 -0.747 . . . . 63.34 112.743 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 44.3 t -103.63 131.86 51.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 120.782 0.325 . . . . 71.33 110.387 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -83.29 113.96 21.06 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.669 -0.493 . . . . 74.24 109.669 177.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 92.9 mt -69.32 159.88 32.31 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.184 -0.462 . . . . 72.03 111.263 -176.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' THR . . . . . 0.628 HG22 ' HG2' ' A' ' 496' ' ' GLU . 7.5 t -89.54 155.14 19.47 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.771 -0.649 . . . . 75.12 110.175 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.5 ttt-85 -79.25 77.04 5.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.724 0.297 . . . . 63.53 110.547 -177.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . 0.628 ' HG2' HG22 ' A' ' 494' ' ' THR . 8.4 pt-20 -176.46 147.25 0.66 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.891 -0.595 . . . . 74.44 109.749 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . 0.45 ' HB2' ' HA ' ' A' ' 502' ' ' TRP . 1.0 OUTLIER -104.52 171.32 7.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.966 0.412 . . . . 72.02 110.398 177.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 7.8 t -149.04 -178.16 6.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.457 -0.572 . . . . 71.21 109.457 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -77.88 -3.84 43.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.793 0.33 . . . . 74.34 111.346 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -82.8 -48.62 10.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.352 0.596 . . . . 75.11 109.535 174.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.609 ' HD2' HD13 ' A' ' 512' ' ' LEU . 19.7 p90 -151.71 141.66 22.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.364 -0.835 . . . . 75.21 109.371 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' TRP . . . . . 0.508 ' HZ3' ' HB2' ' A' ' 504' ' ' LYS . 55.0 p-90 -140.84 150.51 43.37 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.863 0.363 . . . . 74.14 110.602 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . 0.581 ' HA ' ' O ' ' A' ' 511' ' ' HIS . 41.1 p90 -124.76 139.67 53.64 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.14 -0.482 . . . . 72.12 110.147 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.508 ' HB2' ' HZ3' ' A' ' 502' ' ' TRP . 61.2 tttm -116.44 145.24 43.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.02 0.438 . . . . 73.2 110.688 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -107.0 141.78 37.66 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.52 -0.764 . . . . 73.24 109.911 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . 0.512 ' HB3' ' CG ' ' A' ' 509' ' ' ARG . 38.6 t70 -149.94 87.14 1.46 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.863 -0.421 . . . . 63.33 109.863 170.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.45 -87.96 0.2 Allowed Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.769 -0.65 . . . . 73.04 112.675 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -107.52 -27.23 10.52 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.09 0.471 . . . . 74.21 110.924 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.67 ' HA ' ' HB2' ' A' ' 476' ' ' GLU . 6.7 ptp180 -87.99 143.2 27.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.356 0.598 . . . . 73.42 111.684 -170.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -135.12 126.9 29.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.354 -0.839 . . . . 73.43 109.108 179.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . 0.581 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 25.8 m-70 -121.2 126.79 50.53 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.949 -0.389 . . . . 74.43 109.949 -177.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.609 HD13 ' HD2' ' A' ' 501' ' ' TYR . 62.8 tp -110.66 108.06 17.84 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.806 -0.442 . . . . 63.43 109.806 178.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.412 HD11 ' N ' ' A' ' 513' ' ' ILE . 3.7 mp -105.14 123.83 59.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 120.852 0.358 . . . . 74.41 110.648 -176.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.582 HD11 ' HE2' ' A' ' 473' ' ' PHE . 45.1 mt -105.53 122.15 58.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 74.2 109.522 175.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . 0.497 ' HA ' ' HG3' ' A' ' 470' ' ' ARG . 43.1 m-80 -66.13 -42.01 89.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.922 -0.581 . . . . 74.11 111.976 -172.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -140.94 116.02 9.86 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.352 -0.24 . . . . 74.54 110.352 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . 0.416 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -62.6 123.46 18.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.924 -0.398 . . . . 63.12 109.924 175.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' MET . . . . . 0.412 ' HG3' ' N ' ' A' ' 519' ' ' LEU . 45.0 tpp -132.65 171.94 13.19 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.697 -0.483 . . . . 75.42 109.697 -177.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . 0.412 ' N ' ' HG3' ' A' ' 518' ' ' MET . 3.5 mm? -56.46 -32.28 64.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.571 0.224 . . . . 73.54 111.004 177.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -59.25 -37.25 77.11 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.402 0.62 . . . . 72.25 110.525 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -86.73 -13.22 45.96 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.119 -0.946 . . . . 72.32 110.894 -173.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -66.91 7.62 0.36 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.222 0.823 . . . . 74.33 113.222 -176.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . 0.454 ' HA3' ' HB2' ' A' ' 489' ' ' ASP . . . -79.23 165.96 50.99 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.701 -0.761 . . . . 73.04 112.309 178.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 57.1 m170 -71.07 151.39 44.57 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 122.76 -0.259 . . . . 71.04 110.625 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -124.83 124.86 42.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.19 0.519 . . . . 75.21 111.496 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.406 ' HB2' ' HB3' ' A' ' 487' ' ' LEU . . . -128.77 135.44 49.18 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.919 -0.582 . . . . 71.31 110.348 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.588 HD11 ' SG ' ' A' ' 475' ' ' CYS . 2.1 tt -107.95 107.83 18.71 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.999 -0.546 . . . . 73.12 109.909 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 70.2 m -88.8 114.85 25.86 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.073 -0.512 . . . . 74.51 111.676 -174.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.541 ' HB ' ' O ' ' A' ' 532' ' ' GLY . 9.3 m -119.19 158.16 26.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.681 -0.691 . . . . 73.25 109.669 173.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 12.5 m -68.26 -26.65 65.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.804 0.335 . . . . 74.22 111.387 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -87.89 -90.76 1.07 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.824 -0.703 . . . . 70.32 111.637 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . 0.541 ' O ' ' HB ' ' A' ' 529' ' ' THR . . . -97.34 176.05 31.15 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.639 -0.791 . . . . 63.14 111.272 174.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -141.07 126.95 19.23 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.874 -0.417 . . . . 73.02 109.874 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . 0.495 ' HB1' HG22 ' A' ' 456' ' ' ILE . . . -96.93 117.75 31.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.387 -0.369 . . . . 73.42 110.112 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.404 HD21 ' N ' ' A' ' 536' ' ' ALA . 5.4 tt -120.79 127.82 52.31 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.331 -0.618 . . . . 64.22 109.331 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.435 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -148.55 153.88 39.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.267 -0.424 . . . . 74.4 110.157 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -119.18 118.86 32.46 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.373 0.606 . . . . 70.13 110.775 -176.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 44.3 tp -96.86 136.71 37.03 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.942 -1.026 . . . . 75.34 110.125 -177.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.408 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 65.6 mt -116.77 113.36 42.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.148 -0.478 . . . . 73.1 109.783 175.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 44.1 t -101.74 105.48 18.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.886 -0.597 . . . . 73.32 109.695 178.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -88.49 151.15 22.73 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.241 0.543 . . . . 72.13 111.267 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -76.82 162.76 27.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.261 -0.881 . . . . 73.04 112.214 -169.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.405 ' HB3' ' NZ ' ' A' ' 543' ' ' LYS . 8.2 mtpm? . . . . . 0 C--O 1.251 1.159 0 CA-C-N 115.087 -0.96 . . . . 75.43 109.174 173.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.756 0 N-CA-C 111.918 -0.473 . . . . 73.41 111.918 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 43.2 t -113.93 -44.21 3.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.096 0.475 . . . . 71.42 110.284 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -140.84 157.76 44.92 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.077 -0.511 . . . . 72.41 110.12 -178.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 21.9 ptt? -86.02 157.93 56.42 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.298 -0.41 . . . . 74.51 110.119 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -64.79 151.67 84.88 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.162 1.908 . . . . 73.14 111.447 175.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.445 HG23 ' HB3' ' A' ' 530' ' ' SER . 48.3 t -67.12 110.21 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.809 0.338 . . . . 65.24 110.597 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 86.6 mt -78.83 130.47 35.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.968 -0.56 . . . . 75.42 110.524 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 45.7 mm -91.28 110.44 22.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.866 -0.606 . . . . 75.21 110.057 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 26.3 m -79.95 -28.87 39.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.29 -0.414 . . . . 75.05 111.346 -176.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.532 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 36.3 mmt-85 -126.35 119.02 23.26 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.61 -0.268 . . . . 74.31 111.077 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 458' ' ' ARG . 3.0 Cg_exo -76.06 167.27 26.36 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 123.062 2.508 . . . . 64.01 111.548 174.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 91.2 mt -81.94 169.58 16.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.646 0.26 . . . . 75.41 110.609 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -69.57 120.05 14.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.029 -0.532 . . . . 63.42 111.426 -175.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -93.61 -14.36 26.58 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.861 -0.608 . . . . 65.13 111.32 178.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.9 pm0 -90.73 157.42 17.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.335 0.588 . . . . 75.35 111.623 -173.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 10.5 tt -87.48 142.15 28.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.185 -0.916 . . . . 74.52 110.713 -170.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.474 HG21 HG21 ' A' ' 540' ' ' VAL . 28.9 m -126.75 174.0 11.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.996 -0.547 . . . . 70.01 110.269 -179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' MET . . . . . 0.474 ' HG2' ' HG3' ' A' ' 541' ' ' GLN . 46.7 mtm -133.13 162.24 32.26 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.418 -0.355 . . . . 75.44 110.882 -178.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 49.8 t -64.63 137.36 25.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.911 -0.586 . . . . 61.14 111.618 -176.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 100.93 -0.68 55.09 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.764 -0.731 . . . . 71.4 114.039 173.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -120.08 159.0 25.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.42 0.61 . . . . 63.24 110.715 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 514' ' ' ILE . 37.6 ttm105 -87.38 138.59 31.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 63.14 111.176 -175.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 47.1 t -115.96 133.34 62.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.92 -0.582 . . . . 62.32 110.454 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -109.21 122.81 48.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.203 -0.453 . . . . 71.14 110.036 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.647 ' HZ ' HD21 ' A' ' 538' ' ' LEU . 64.9 m-85 -108.31 112.29 24.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.385 -0.371 . . . . 73.25 110.418 176.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.521 ' HG2' ' CE1' ' A' ' 511' ' ' HIS . 33.7 mt-10 -98.71 120.11 38.59 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.284 -0.636 . . . . 64.2 109.284 174.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.532 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 13.9 t -144.84 109.16 4.84 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.089 -0.708 . . . . 73.34 109.089 171.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.506 ' OE1' ' HB2' ' A' ' 509' ' ' ARG . 0.4 OUTLIER -113.93 134.63 54.7 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.699 -0.852 . . . . 74.11 108.699 -176.277 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.494 HG21 ' HB3' ' A' ' 482' ' ' ALA . 30.0 m -95.61 145.23 8.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.567 -0.531 . . . . 64.31 109.567 176.468 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 32.3 t -72.64 -11.73 60.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.328 -0.396 . . . . 64.35 111.721 -175.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -133.12 137.62 46.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.846 0.355 . . . . 65.04 111.886 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -71.01 149.3 46.77 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.855 -0.611 . . . . 75.31 109.663 174.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 84.42 15.43 68.83 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.663 -0.78 . . . . 72.55 112.34 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.494 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -91.73 110.47 21.81 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.799 0.333 . . . . 72.05 110.733 177.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.53 143.89 55.91 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.948 -0.569 . . . . 63.14 110.515 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 22.3 m -128.62 143.41 41.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.215 -0.448 . . . . 73.54 110.497 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 528' ' ' CYS . 25.1 ttmm -129.09 129.25 44.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.056 -0.52 . . . . 75.53 110.155 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -98.46 119.77 37.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.124 0.488 . . . . 75.51 110.762 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 7.8 tt -116.99 119.74 36.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.734 -0.666 . . . . 74.23 109.331 178.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -105.05 105.73 15.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.418 -0.356 . . . . 74.4 110.815 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . 0.43 ' HB2' ' HA3' ' A' ' 523' ' ' GLY . 4.0 t70 46.88 46.33 15.44 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.257 -0.883 . . . . 65.33 111.33 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.36 -27.25 20.29 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.743 -0.662 . . . . 72.11 113.22 177.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 47.5 t -101.5 119.22 49.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 117.12 0.46 . . . . 63.44 110.775 -176.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -65.32 128.73 37.06 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.725 -0.472 . . . . 71.04 109.725 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 4.4 pp -91.52 163.13 14.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.758 0.313 . . . . 71.44 110.301 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 2.4 p -100.05 142.66 31.23 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.086 0.47 . . . . 72.11 111.583 -176.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.41 2.29 9.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.652 -0.703 . . . . 73.23 111.427 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -126.77 34.68 4.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.156 -0.475 . . . . 70.33 110.767 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -82.98 -179.94 7.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.892 -0.594 . . . . 71.41 111.396 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 13.7 t -65.11 165.71 10.77 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.824 -0.626 . . . . 72.45 111.635 -176.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -74.93 14.26 0.54 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.626 -0.715 . . . . 74.53 112.603 -173.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -59.15 -44.93 92.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.214 0.53 . . . . 75.45 110.218 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.413 ' CB ' HG12 ' A' ' 514' ' ' ILE . 1.5 p90 -144.62 125.04 13.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.516 -0.766 . . . . 74.1 109.681 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -123.26 160.24 27.04 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.831 -0.622 . . . . 74.33 110.162 -174.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -124.02 151.08 44.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.14 0.495 . . . . 65.1 111.357 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -117.16 138.27 51.78 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.524 -0.762 . . . . 71.32 109.939 175.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.763 ' HZ1' ' HB3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -113.77 105.1 12.88 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.66 -0.867 . . . . 75.04 108.66 175.806 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . 0.612 ' HB2' ' HG2' ' A' ' 509' ' ' ARG . 32.4 m-20 -115.39 88.36 2.86 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.565 -0.531 . . . . 73.42 109.565 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 64.15 -94.8 0.16 Allowed Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.873 -0.603 . . . . 73.23 112.584 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . 0.493 ' O ' HG23 ' A' ' 477' ' ' VAL . 20.2 pt20 -103.31 -20.69 14.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.898 0.38 . . . . 75.15 111.108 -177.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.612 ' HG2' ' HB2' ' A' ' 506' ' ' ASP . 28.6 ptt180 -92.28 148.87 21.8 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.441 -0.504 . . . . 74.53 111.075 -172.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -134.47 117.13 15.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.783 -0.644 . . . . 73.2 109.906 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . 0.521 ' CE1' ' HG2' ' A' ' 474' ' ' GLU . 23.1 m-70 -121.22 126.79 50.49 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.806 -0.358 . . . . 73.43 111.098 -177.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 58.3 tp -107.33 117.36 33.86 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.107 -0.701 . . . . 72.51 109.107 176.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 68.6 mt -111.51 108.33 25.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 120.961 0.41 . . . . 71.45 110.871 -175.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.493 ' O ' ' HG3' ' A' ' 470' ' ' ARG . 35.8 mt -86.86 120.55 36.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.543 -0.91 . . . . 75.23 108.543 173.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -68.61 -45.88 70.77 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.899 -0.32 . . . . 74.51 110.715 -176.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -140.61 109.12 5.89 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.641 -0.503 . . . . 72.53 109.641 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . 0.538 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -64.62 136.43 56.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.954 -0.566 . . . . 74.34 111.013 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 72.1 mtm -134.16 174.91 9.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.96 -0.563 . . . . 75.43 110.521 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.53 -33.0 52.96 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.769 0.655 . . . . 64.23 112.769 -171.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.71 -29.7 68.3 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.412 0.625 . . . . 74.25 111.297 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . 0.456 ' HB2' HG22 ' A' ' 540' ' ' VAL . 30.3 m-20 -82.14 -11.86 58.5 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.326 -0.852 . . . . 74.3 111.462 -170.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.467 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -67.22 6.61 0.53 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.394 0.516 . . . . 74.21 112.394 178.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . 0.43 ' HA3' ' HB2' ' A' ' 489' ' ' ASP . . . -80.99 167.99 50.37 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 121.051 -0.595 . . . . 64.22 112.359 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . 0.408 ' CD2' ' HB3' ' A' ' 537' ' ' GLU . 62.8 m80 -79.86 106.58 11.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.688 0.28 . . . . 74.31 110.935 -178.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -76.57 124.36 27.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.383 0.611 . . . . 74.44 111.035 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -123.75 135.95 54.14 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.464 -0.789 . . . . 52.03 109.585 175.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 534' ' ' ALA . 6.2 tt -117.2 108.64 15.91 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.425 -0.583 . . . . 71.23 109.425 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 485' ' ' LYS . 42.3 t -86.76 115.29 24.1 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.051 -0.722 . . . . 73.32 109.051 176.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.3 175.18 6.69 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.501 -0.318 . . . . 70.4 110.417 -176.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 530' ' ' SER . . . . . 0.445 ' HB3' HG23 ' A' ' 454' ' ' VAL . 22.9 t -65.3 -5.99 8.69 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.922 0.391 . . . . 75.44 111.313 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -149.5 -54.81 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.711 -0.757 . . . . 73.1 112.469 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -95.47 -171.49 36.31 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.803 -0.713 . . . . 42.44 112.837 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -140.98 136.93 32.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.876 0.37 . . . . 71.0 110.407 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . 0.582 ' HB3' ' HB3' ' A' ' 527' ' ' LEU . . . -115.98 143.52 45.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.119 -0.491 . . . . 74.24 109.954 176.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 64.3 tp -147.29 126.19 12.75 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.62 -0.264 . . . . 75.21 110.445 -178.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -150.1 152.01 34.09 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.259 -0.428 . . . . 54.21 110.208 177.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . 0.408 ' HB3' ' CD2' ' A' ' 524' ' ' HIS . 10.4 pt-20 -108.38 113.98 27.48 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.148 0.499 . . . . 73.11 110.41 178.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.647 HD21 ' HZ ' ' A' ' 473' ' ' PHE . 39.4 tp -96.3 111.43 23.5 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.928 -0.767 . . . . 72.42 108.928 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 48.4 mt -93.06 112.74 26.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 116.409 -0.36 . . . . 71.45 110.342 -177.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.474 HG21 HG21 ' A' ' 465' ' ' VAL . 24.6 t -109.4 113.14 43.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.831 -0.622 . . . . 71.14 109.787 177.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . 0.474 ' HG3' ' HG2' ' A' ' 466' ' ' MET . 8.0 pt20 -115.18 157.24 23.93 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.023 0.439 . . . . 72.02 110.978 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -78.69 135.23 37.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.541 -0.754 . . . . 74.23 110.282 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 467' ' ' VAL . 59.0 pttt . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.735 -0.65 . . . . 75.4 109.901 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.769 0 N-CA-C 111.861 -0.496 . . . . 75.25 111.861 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 6.9 p -67.17 -52.83 36.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.959 0.409 . . . . 70.23 111.242 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 66.0 m80 -78.73 104.64 9.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.01 -0.541 . . . . 74.23 110.213 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' MET . . . . . 0.407 ' HA ' ' HD3' ' A' ' 453' ' ' PRO . 44.4 ttm -123.91 119.75 26.68 Favored Pre-proline 0 C--N 1.318 -0.804 0 CA-C-N 115.852 -0.613 . . . . 75.21 110.544 -175.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 452' ' ' MET . 6.0 Cg_exo -78.41 158.67 29.3 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.728 2.286 . . . . 74.34 111.405 176.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 56.9 t -66.92 112.48 2.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 109.926 -0.398 . . . . 73.41 109.926 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 89.6 mt -90.06 144.09 26.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.521 . . . . 74.13 111.458 -175.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . 0.472 HD13 HG11 ' A' ' 477' ' ' VAL . 42.9 mm -104.73 113.6 42.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.649 -0.705 . . . . 75.55 109.876 178.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' THR . . . . . 0.434 ' HG1' ' HG3' ' A' ' 476' ' ' GLU . 2.9 p -93.8 -4.84 49.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.843 0.354 . . . . 63.44 111.873 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.6 ' HB2' ' HG2' ' A' ' 476' ' ' GLU . 0.0 OUTLIER -135.02 99.68 12.25 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.562 -0.29 . . . . 74.44 110.544 177.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -71.64 167.15 27.27 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.651 2.234 . . . . 72.3 111.973 174.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.496 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 79.0 mt -83.66 171.05 13.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.275 -0.42 . . . . 72.03 111.407 -175.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . 0.442 ' HB2' ' HE1' ' A' ' 473' ' ' PHE . 7.8 mm-40 -67.7 118.38 10.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.921 -0.581 . . . . 71.54 111.089 -179.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -95.37 -11.24 28.06 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.908 -0.587 . . . . 74.33 111.838 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -88.65 157.5 18.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.293 0.568 . . . . 73.43 111.794 -170.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 8.8 tt -87.24 131.88 34.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.394 -0.821 . . . . 74.21 110.228 -172.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 33.1 m -124.92 176.24 6.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.871 -0.604 . . . . 74.31 110.659 -177.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -113.69 157.51 22.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.046 0.451 . . . . 74.12 110.926 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 73.3 t -66.49 138.67 22.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.549 -0.751 . . . . 74.34 111.272 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.01 -2.06 55.25 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.913 -0.661 . . . . 71.25 114.004 174.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -110.28 163.08 13.99 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 117.671 0.736 . . . . 75.54 111.068 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -82.28 131.03 35.23 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.725 -0.671 . . . . 72.34 110.863 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 60.7 t -131.61 122.0 49.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.243 -0.435 . . . . 74.2 110.169 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.602 ' HG2' HG12 ' A' ' 513' ' ' ILE . 21.8 mt-10 -101.68 138.58 38.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.079 0.466 . . . . 75.45 111.222 176.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.636 ' HZ ' HD21 ' A' ' 538' ' ' LEU . 35.3 m-85 -105.69 112.98 26.27 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.943 -0.762 . . . . 73.01 108.943 171.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.405 ' HB2' ' HE ' ' A' ' 458' ' ' ARG . 42.8 mt-10 -98.29 117.63 33.12 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.467 -0.568 . . . . 63.01 109.467 179.523 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.487 ' HA ' ' HB3' ' A' ' 458' ' ' ARG . 22.5 t -132.72 125.28 29.87 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.793 -0.447 . . . . 74.44 109.793 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.6 ' HG2' ' HB2' ' A' ' 458' ' ' ARG . 11.3 pt-20 -133.08 153.76 51.21 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.958 -0.564 . . . . 74.11 109.996 178.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.516 HG21 ' HB1' ' A' ' 482' ' ' ALA . 8.1 m -117.37 155.49 19.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 115.465 -0.789 . . . . 64.43 109.906 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 6.5 p -81.16 -2.44 48.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.056 0.455 . . . . 75.23 111.638 -177.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -124.4 130.47 52.54 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.604 -0.887 . . . . 71.44 108.604 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -89.13 132.76 34.67 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.226 0.536 . . . . 73.21 111.605 -174.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 102.73 6.42 46.58 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.81 -0.71 . . . . 74.1 111.975 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.516 ' HB1' HG21 ' A' ' 477' ' ' VAL . . . -82.13 127.53 33.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.694 0.283 . . . . 70.3 110.481 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -80.09 142.85 34.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.117 -0.492 . . . . 73.33 110.671 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.516 HG12 HG22 ' A' ' 529' ' ' THR . 35.7 m -124.04 148.77 28.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.965 -0.561 . . . . 71.31 110.579 -177.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 1.3 tpmt? -127.29 134.84 49.98 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.25 -0.432 . . . . 74.23 110.238 178.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -97.85 120.83 38.94 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.941 -0.392 . . . . 74.42 109.941 177.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 51.0 tp -116.82 120.61 39.05 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.651 -0.5 . . . . 74.13 109.651 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.44 ' HD3' ' C ' ' A' ' 488' ' ' LYS . 14.2 tmtt? -109.3 106.89 16.9 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.862 0.363 . . . . 74.35 110.599 -176.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.6 t70 51.02 37.86 18.95 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.534 -0.757 . . . . 65.13 111.871 174.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 91.92 -14.04 65.33 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.769 -0.729 . . . . 52.53 112.641 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 40.0 t -94.33 130.0 43.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.783 0.325 . . . . 73.12 110.171 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -89.96 114.66 26.52 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.546 -0.909 . . . . 74.52 108.546 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.523 HD13 ' O ' ' A' ' 493' ' ' LEU . 2.2 pp -74.0 134.35 43.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.703 0.763 . . . . 75.43 112.125 -172.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.93 174.53 11.52 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.079 -0.964 . . . . 75.23 111.265 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . 0.469 ' N ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -115.81 22.58 12.95 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.865 0.32 . . . . 73.34 111.865 -167.81 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 19.9 pm0 -126.74 20.25 7.15 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.661 0.245 . . . . 74.33 111.661 -177.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -82.87 159.94 22.26 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.579 0.228 . . . . 75.34 110.627 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 14.2 t -75.83 -179.67 4.95 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.149 0.499 . . . . 71.15 111.463 -176.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -81.28 19.64 0.93 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.672 0.619 . . . . 62.45 112.672 -172.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . 0.507 ' O ' ' HB3' ' A' ' 515' ' ' ASN . 58.7 tttp -63.17 -21.52 66.26 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.832 -0.803 . . . . 72.11 108.832 173.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.48 ' HB2' ' HA ' ' A' ' 514' ' ' ILE . 21.1 p90 -155.16 147.42 23.83 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 108.015 -1.105 . . . . 75.32 108.015 167.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 8.5 p-90 -154.09 159.12 41.36 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.212 -0.292 . . . . 75.42 110.212 -175.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -111.31 161.24 16.25 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.699 -0.4 . . . . 74.12 111.309 -177.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.957 ' HG2' ' HB2' ' A' ' 511' ' ' HIS . 14.4 ptpt -129.73 149.54 51.43 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 109.028 -0.73 . . . . 70.44 109.028 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.45 121.37 44.09 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.853 0.359 . . . . 73.22 110.509 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -115.97 80.96 1.52 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.568 -0.53 . . . . 71.42 109.568 175.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.65 -110.33 3.39 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.796 -0.716 . . . . 72.24 112.293 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -95.28 -5.54 43.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.347 0.594 . . . . 74.33 110.191 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.565 ' HG2' ' CB ' ' A' ' 476' ' ' GLU . 68.4 mtt85 -100.17 134.15 43.53 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.592 -0.731 . . . . 74.32 110.546 -175.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -116.51 134.38 54.92 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.825 0.345 . . . . 74.41 110.511 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . 0.957 ' HB2' ' HG2' ' A' ' 504' ' ' LYS . 11.5 m170 -117.91 123.2 45.25 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.111 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.455 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 46.7 tp -98.26 105.6 17.77 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.452 -0.573 . . . . 72.54 109.452 172.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.692 HD12 ' HE2' ' A' ' 504' ' ' LYS . 16.4 mt -93.67 107.6 19.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.937 -0.574 . . . . 73.52 110.451 -176.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.48 ' HA ' ' HB2' ' A' ' 501' ' ' TYR . 45.4 mt -78.13 114.89 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 106.615 -1.624 . . . . 73.25 106.615 168.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . 0.507 ' HB3' ' O ' ' A' ' 500' ' ' LYS . 9.3 t30 -72.51 -42.04 65.24 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.356 0.598 . . . . 65.12 109.838 -176.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -130.95 104.1 6.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.294 -0.866 . . . . 65.34 109.919 174.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -55.64 133.87 50.83 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.218 -0.66 . . . . 63.22 109.218 173.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' MET . . . . . 0.427 ' H ' ' HB3' ' A' ' 521' ' ' ASP . 6.9 tpt -134.18 171.53 14.11 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.814 0.34 . . . . 75.34 111.389 -169.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . 0.771 HD13 ' HB2' ' A' ' 542' ' ' GLU . 3.8 mm? -64.75 -49.27 71.43 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.306 -0.406 . . . . 75.04 111.699 -178.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -67.77 -22.41 65.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.141 0.496 . . . . 63.11 109.88 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . 0.427 ' HB3' ' H ' ' A' ' 518' ' ' MET . 16.6 t70 -74.74 -16.5 60.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.246 -0.888 . . . . 73.42 111.115 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -67.96 7.94 0.47 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.788 0.662 . . . . 61.35 112.788 -178.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . 0.406 ' H ' ' C ' ' A' ' 521' ' ' ASP . . . -73.77 169.42 53.57 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 121.079 -0.581 . . . . 74.11 112.111 178.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 65.1 m170 -72.49 147.07 46.39 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.487 -0.42 . . . . 72.53 110.16 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -119.78 135.53 54.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.143 0.497 . . . . 74.22 111.431 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.428 ' HB2' ' HG ' ' A' ' 535' ' ' LEU . . . -144.06 135.46 25.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.839 -0.619 . . . . 62.13 110.637 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 10.5 tt -113.25 129.37 56.54 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.111 -0.7 . . . . 73.2 109.111 175.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 28.1 t -117.71 137.15 52.88 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.835 0.35 . . . . 74.1 110.27 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.516 HG22 HG12 ' A' ' 484' ' ' VAL . 67.5 p -109.55 -174.2 2.44 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.026 -0.534 . . . . 74.32 109.885 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 3.6 m -66.6 -11.17 52.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.167 -0.47 . . . . 71.3 110.651 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -115.8 -90.47 1.64 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 121.149 -0.548 . . . . 73.21 112.293 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -104.32 -173.06 25.08 Favored Glycine 0 C--O 1.236 0.221 0 C-N-CA 120.675 -0.774 . . . . 54.11 112.613 -178.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -133.83 156.74 47.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.895 0.379 . . . . 74.02 110.802 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -125.62 117.79 24.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.847 -0.615 . . . . 72.13 109.867 175.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.428 ' HG ' ' HB2' ' A' ' 526' ' ' ALA . 7.2 tt -118.37 132.85 56.25 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.347 -0.388 . . . . 75.22 110.414 -176.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.496 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -148.79 142.06 25.11 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.831 -0.622 . . . . 75.51 109.652 176.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -97.74 119.44 36.33 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.405 0.621 . . . . 72.33 111.042 -177.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.636 HD21 ' HZ ' ' A' ' 473' ' ' PHE . 43.8 tp -96.49 112.51 24.23 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.668 -0.697 . . . . 75.43 109.319 177.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 52.9 mt -93.64 112.16 26.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.694 -0.484 . . . . 63.11 109.694 178.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 23.4 t -106.16 110.97 33.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.111 -0.495 . . . . 73.1 110.138 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -94.11 138.4 32.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.09 -0.505 . . . . 74.51 110.789 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . 0.771 ' HB2' HD13 ' A' ' 519' ' ' LEU . 21.3 tt0 -79.18 159.46 27.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.3 -0.409 . . . . 74.34 109.919 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.755 ' HD3' ' HG2' ' A' ' 542' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.473 -0.775 . . . . 74.2 110.498 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.652 0 N-CA-C 111.872 -0.491 . . . . 64.04 111.872 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 4.9 m -69.99 -59.7 2.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.462 0.172 . . . . 74.21 111.433 -176.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 72.9 m-70 61.16 29.04 18.6 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.486 0.66 . . . . 73.41 110.366 -174.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 66.2 mtt -109.57 167.28 9.34 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.423 -0.808 . . . . 71.34 109.657 -178.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -53.92 155.07 15.44 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.297 1.998 . . . . 74.13 111.737 174.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.43 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 30.6 t -65.94 123.75 19.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.419 -0.355 . . . . 73.12 110.275 -177.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 6.6 mp -78.55 140.22 38.54 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.953 -0.567 . . . . 51.02 110.859 -177.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . 0.568 HG13 ' HB2' ' A' ' 534' ' ' ALA . 33.7 mm -91.86 112.04 25.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.577 -0.738 . . . . 62.12 109.432 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' THR . . . . . 0.421 ' OG1' ' HG3' ' A' ' 476' ' ' GLU . 0.4 OUTLIER -85.29 -25.62 27.1 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.095 0.405 . . . . 72.12 112.095 -177.041 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.498 ' HB2' ' HG2' ' A' ' 476' ' ' GLU . 6.4 mmm180 -130.61 111.66 16.32 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 110.096 -0.335 . . . . 72.45 110.096 177.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.15 168.5 23.9 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.966 2.444 . . . . 75.13 112.019 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.465 HD13 ' HB3' ' A' ' 473' ' ' PHE . 3.5 mm? -80.22 160.08 25.72 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.924 -0.398 . . . . 71.34 109.924 -178.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . 0.57 ' HB3' ' NE2' ' A' ' 463' ' ' GLN . 27.1 mm-40 -58.55 119.02 6.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.904 -0.589 . . . . 73.21 111.071 -176.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -93.15 -10.94 34.08 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.675 -0.693 . . . . 72.14 111.616 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . 0.57 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 6.0 pm0 -88.53 156.51 19.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.117 0.484 . . . . 73.12 111.254 -174.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 10.5 tt -87.07 138.39 31.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.661 -0.7 . . . . 72.55 110.981 -168.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.52 HG22 HD11 ' A' ' 538' ' ' LEU . 29.7 m -125.98 177.6 5.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.74 -0.664 . . . . 72.12 110.809 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' MET . . . . . 0.476 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 38.1 mtm -133.62 156.1 48.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.758 0.314 . . . . 74.51 111.202 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . 0.48 ' CG2' ' HA ' ' A' ' 542' ' ' GLU . 55.8 t -64.53 144.47 14.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.684 -0.689 . . . . 73.05 111.768 -178.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 102.26 -25.25 28.37 Favored Glycine 0 C--N 1.332 0.307 0 CA-C-N 115.948 -0.569 . . . . 72.24 113.627 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 466' ' ' MET . 13.2 pt20 -98.23 168.35 10.29 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 117.237 0.519 . . . . 64.42 110.365 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 24.9 ttm180 -84.93 136.66 33.53 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.913 -0.403 . . . . 73.22 109.913 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 23.4 t -122.09 122.12 65.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.619 -0.511 . . . . 70.52 109.619 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.523 ' HG2' HG22 ' A' ' 513' ' ' ILE . 49.5 mt-10 -116.54 128.47 55.46 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.74 0.305 . . . . 72.2 110.56 -178.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.705 ' HD2' HD21 ' A' ' 512' ' ' LEU . 20.0 m-85 -105.06 127.15 52.75 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.327 -0.62 . . . . 65.41 109.327 179.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -111.55 116.75 31.36 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.109 0.481 . . . . 71.44 110.048 176.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 25.9 p -138.74 158.21 44.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.678 -0.692 . . . . 62.23 110.042 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.498 ' HG2' ' HB2' ' A' ' 458' ' ' ARG . 7.8 pt-20 -161.24 170.55 20.04 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.368 -0.378 . . . . 75.3 110.16 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.569 HG23 ' HB1' ' A' ' 482' ' ' ALA . 19.9 m -126.16 168.48 19.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.641 -0.708 . . . . 73.22 109.827 177.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 7.8 t -81.26 -1.05 43.49 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.439 -0.346 . . . . 42.11 111.322 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -117.2 133.96 55.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.087 0.47 . . . . 73.41 110.691 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -71.75 124.78 25.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 74.42 111.668 -175.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 71.72 31.91 64.62 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.108 -0.568 . . . . 71.12 113.284 174.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.569 ' HB1' HG23 ' A' ' 477' ' ' VAL . . . -81.56 133.37 35.37 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 122.607 -0.349 . . . . 74.43 110.535 176.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -68.23 142.49 55.62 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.695 -0.684 . . . . 74.44 110.395 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.498 HG13 HG22 ' A' ' 529' ' ' THR . 27.4 m -124.9 146.34 30.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.198 0.523 . . . . 71.1 110.76 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -117.9 135.53 54.05 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.412 -0.813 . . . . 74.43 109.053 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . 0.522 ' HB3' HD11 ' A' ' 493' ' ' LEU . 99.2 m95 -98.05 121.42 39.95 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.219 0.533 . . . . 75.05 110.312 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 20.2 tp -116.11 151.68 35.13 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.409 -0.814 . . . . 73.01 109.292 -178.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -136.86 105.22 5.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.803 0.335 . . . . 73.34 110.454 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 16.0 t70 47.13 40.22 9.49 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.326 -0.852 . . . . 74.53 111.663 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.47 -26.3 24.38 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.808 -0.711 . . . . 74.15 113.212 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 57.9 t -91.64 135.82 26.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 110.032 -0.359 . . . . 54.5 110.032 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -83.53 136.08 34.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.522 0.201 . . . . 75.52 110.564 -177.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.522 HD11 ' HB3' ' A' ' 486' ' ' TRP . 70.1 mt -69.09 153.89 42.98 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.946 -0.39 . . . . 74.43 109.946 178.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' THR . . . . . 0.49 HG23 ' HG2' ' A' ' 496' ' ' GLU . 1.3 m -74.98 142.19 43.92 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.19 0.519 . . . . 74.4 112.104 -170.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 10.6 ptp85 -68.44 -20.75 64.66 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.744 -0.662 . . . . 75.04 110.431 175.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . 0.49 ' HG2' HG23 ' A' ' 494' ' ' THR . 9.1 pt-20 -116.52 39.11 3.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.278 -0.874 . . . . 73.14 109.204 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . 0.481 ' HG2' ' HH ' ' A' ' 501' ' ' TYR . 7.3 tp10 -62.85 154.88 28.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.192 -0.913 . . . . 74.13 111.568 -174.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 9.6 t -60.22 150.6 29.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.511 -0.768 . . . . 73.44 111.396 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -86.23 18.25 3.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.002 -0.544 . . . . 71.22 111.248 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . 0.406 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 39.6 tttp -72.61 -24.24 61.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.358 -0.608 . . . . 71.1 109.358 177.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.481 ' HH ' ' HG2' ' A' ' 497' ' ' GLU . 13.4 p90 -146.14 138.52 25.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.285 -0.871 . . . . 74.44 108.96 173.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -135.39 160.24 39.05 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.855 0.359 . . . . 74.12 111.446 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . 0.409 ' HB3' HD11 ' A' ' 512' ' ' LEU . 40.8 p90 -119.17 138.26 53.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.115 0.483 . . . . 75.34 110.734 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -116.89 131.4 56.96 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.707 -0.678 . . . . 70.33 110.274 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -101.53 128.47 47.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.419 -0.355 . . . . 73.33 110.653 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -135.56 81.75 1.91 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.075 -0.511 . . . . 64.05 109.742 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 75.14 -118.0 5.47 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 121.007 -0.616 . . . . 75.05 112.151 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -86.11 -13.88 45.9 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.94 0.4 . . . . 75.31 110.407 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.489 ' HG2' ' HB3' ' A' ' 476' ' ' GLU . 70.6 mtt180 -97.58 139.14 33.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.408 0.623 . . . . 74.14 111.497 -174.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -130.44 119.18 22.29 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.401 -0.818 . . . . 74.52 109.638 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 41.7 m-70 -105.54 124.91 50.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.438 -0.346 . . . . 74.41 110.189 -177.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.705 HD21 ' HD2' ' A' ' 473' ' ' PHE . 50.6 tp -106.31 105.86 16.1 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.696 -0.483 . . . . 72.0 109.696 176.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.523 HG22 ' HG2' ' A' ' 472' ' ' GLU . 4.8 mp -101.75 110.6 28.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 116.187 -0.461 . . . . 71.33 110.622 -174.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.462 ' HA ' ' CB ' ' A' ' 501' ' ' TYR . 55.4 mt -92.4 116.99 34.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 108.575 -0.898 . . . . 74.5 108.575 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -70.64 -42.76 70.43 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.1 -0.5 . . . . 61.24 111.345 -175.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . 0.406 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 26.2 mt-10 -134.17 105.24 6.56 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.871 -0.604 . . . . 73.44 109.627 -178.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . 0.461 ' O ' HG11 ' A' ' 467' ' ' VAL . . . -56.53 123.04 13.43 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.548 0.53 . . . . 64.23 110.306 177.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 14.4 tpt -113.81 169.09 9.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.133 -0.485 . . . . 73.21 110.111 -175.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . 0.984 ' HG ' ' HG2' ' A' ' 542' ' ' GLU . 7.2 mp -58.12 -33.04 68.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.108 0.48 . . . . 64.24 110.491 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -60.91 -32.48 71.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.473 -0.785 . . . . 74.14 112.233 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -69.32 -14.23 62.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.766 0.317 . . . . 75.3 111.818 -172.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -62.71 -23.23 67.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.086 0.469 . . . . 74.2 110.088 172.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -67.54 123.73 20.35 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.824 -0.91 . . . . 74.31 110.824 173.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -66.76 125.74 26.82 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.127 0.489 . . . . 62.54 111.694 -170.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -92.95 152.48 19.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.594 -0.73 . . . . 73.54 110.522 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.51 143.24 43.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.965 -0.561 . . . . 75.45 110.744 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.459 ' HB2' HD23 ' A' ' 460' ' ' LEU . 58.6 tp -100.97 114.13 27.75 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.049 -0.523 . . . . 61.32 109.907 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 42.3 t -112.89 128.82 56.57 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.191 -0.459 . . . . 63.4 110.08 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.498 HG22 HG13 ' A' ' 484' ' ' VAL . 75.8 p -114.69 -174.3 2.46 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.492 -0.559 . . . . 74.11 109.492 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 12.4 p -68.0 -8.93 41.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.65 -0.25 . . . . 73.4 111.575 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -143.68 -48.55 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.705 -0.759 . . . . 24.43 113.301 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -98.74 156.97 20.22 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.646 -0.788 . . . . 54.0 113.121 -174.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -131.99 125.43 31.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.368 0.267 . . . . 73.33 110.292 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . 0.568 ' HB2' HG13 ' A' ' 456' ' ' ILE . . . -121.53 118.1 28.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.708 -0.224 . . . . 72.13 110.791 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 64.0 tp -109.66 138.96 45.27 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.996 0.427 . . . . 74.41 110.622 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -139.52 145.17 38.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.758 -0.656 . . . . 65.1 109.557 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -105.63 110.0 22.16 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.544 0.688 . . . . 75.24 110.458 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.52 HD11 HG22 ' A' ' 465' ' ' VAL . 49.1 tp -103.39 132.58 49.53 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.534 -0.757 . . . . 72.32 110.037 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.548 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 67.8 mt -117.85 112.92 40.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.723 -0.473 . . . . 72.52 109.723 176.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.406 HG22 HG21 ' A' ' 465' ' ' VAL . 45.8 t -108.39 108.65 25.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.302 -0.408 . . . . 75.41 110.244 -179.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -85.55 134.08 34.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.921 0.391 . . . . 74.13 110.41 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . 0.984 ' HG2' ' HG ' ' A' ' 519' ' ' LEU . 1.0 OUTLIER -83.95 149.82 26.06 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.706 -0.679 . . . . 62.23 111.404 -174.325 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 C--O 1.249 1.046 0 CA-C-N 115.58 -0.736 . . . . 75.21 109.532 175.234 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.698 0 N-CA-C 112.03 -0.428 . . . . 62.43 112.03 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 41.2 t -82.57 -75.04 0.32 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.032 0.444 . . . . 73.14 110.098 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 30.0 m-70 -124.28 13.87 8.94 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.302 0.573 . . . . 74.52 110.063 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' MET . . . . . 0.449 ' HA ' ' HD3' ' A' ' 453' ' ' PRO . 25.9 mmt -88.37 138.12 30.46 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 115.508 -0.769 . . . . 74.24 109.361 176.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 452' ' ' MET . 25.4 Cg_exo -62.96 159.15 39.62 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 122.701 2.268 . . . . 71.13 112.494 -178.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 57.3 t -66.87 116.11 5.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.982 -0.553 . . . . 73.51 109.583 175.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.31 153.14 17.82 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.045 0.45 . . . . 75.32 110.977 -174.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 27.7 mm -105.76 117.83 52.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.785 -0.643 . . . . 74.14 109.733 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' THR . . . . . 0.565 ' CG2' ' HB2' ' A' ' 476' ' ' GLU . 15.1 t -91.26 2.63 56.23 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.271 0.558 . . . . 65.33 110.763 -177.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.407 ' HB2' ' H ' ' A' ' 476' ' ' GLU . 75.4 mmt-85 -138.84 94.5 10.14 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.708 -0.678 . . . . 73.21 109.663 173.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -67.45 157.31 62.37 Favored 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.479 2.12 . . . . 71.32 111.467 178.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.423 HD11 ' HB3' ' A' ' 473' ' ' PHE . 3.1 mm? -80.96 146.66 30.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.357 -0.609 . . . . 53.3 109.357 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . 0.641 ' HB2' ' OE1' ' A' ' 463' ' ' GLN . 6.0 pt-20 -82.91 126.77 32.86 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.968 0.889 . . . . 73.12 112.462 -171.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -92.55 -6.94 48.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 113.934 -1.485 . . . . 64.25 112.791 -173.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . 0.641 ' OE1' ' HB2' ' A' ' 461' ' ' GLU . 4.6 pm0 -83.73 161.33 21.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.294 0.569 . . . . 75.2 110.954 -169.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.824 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 1.2 tt -84.72 132.1 34.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.339 -0.846 . . . . 63.42 111.609 -161.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 33.0 m -120.81 177.73 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.357 -0.838 . . . . 63.0 109.693 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' MET . . . . . 0.439 ' O ' ' HB3' ' A' ' 469' ' ' GLN . 23.0 ptp -124.5 163.11 22.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.696 0.284 . . . . 75.01 111.017 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 541' ' ' GLN . 59.6 t -62.53 130.31 26.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 70.13 111.179 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . 0.447 ' HA2' ' HB3' ' A' ' 516' ' ' GLU . . . 93.48 -11.88 70.65 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.937 -0.649 . . . . 72.43 112.353 178.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.439 ' HB3' ' O ' ' A' ' 466' ' ' MET . 29.5 tt0 -76.31 132.37 39.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.951 0.405 . . . . 72.12 111.035 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -73.86 127.04 31.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.609 -0.723 . . . . 75.21 110.251 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 47.5 t -132.52 126.86 55.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.202 -0.454 . . . . 65.24 110.601 -178.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -103.86 131.07 51.42 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.126 -0.324 . . . . 75.4 110.126 174.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.423 ' HB3' HD11 ' A' ' 460' ' ' LEU . 55.0 m-85 -107.07 110.98 23.24 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.124 -0.489 . . . . 72.24 109.748 176.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -104.97 129.86 53.29 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.346 -0.388 . . . . 73.41 110.296 -178.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 9.0 p -143.46 111.68 6.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.219 0.533 . . . . 72.04 110.292 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.565 ' HB2' ' CG2' ' A' ' 457' ' ' THR . 2.0 mm-40 -108.51 132.23 54.03 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.125 -0.694 . . . . 74.44 109.125 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 508' ' ' GLN . 34.9 m -95.33 144.64 9.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 110.044 -0.354 . . . . 63.4 110.044 179.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 58.9 p -85.79 -2.59 58.38 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.81 0.338 . . . . 63.22 111.446 -177.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -124.04 133.16 53.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.334 -0.394 . . . . 73.11 110.222 -178.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -77.98 150.13 33.98 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.018 -0.364 . . . . 65.43 110.018 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 84.41 16.29 66.86 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.495 -0.859 . . . . 71.32 112.116 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.44 110.89 22.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.964 0.411 . . . . 72.3 110.535 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . 0.437 ' O ' ' HA ' ' A' ' 529' ' ' THR . 27.2 mp0 -80.97 157.92 25.37 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.126 -0.694 . . . . 73.34 109.126 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.525 HG13 HG21 ' A' ' 529' ' ' THR . 24.5 m -128.1 143.16 41.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.246 0.546 . . . . 62.21 111.579 -175.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . 0.532 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 21.5 ttmm -127.59 131.69 49.92 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.404 -0.816 . . . . 73.13 109.37 174.18 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . 0.436 ' HB2' HD11 ' A' ' 493' ' ' LEU . 98.0 m95 -98.17 115.91 29.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.303 0.573 . . . . 74.22 110.258 178.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 37.3 tp -116.63 120.89 40.08 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.342 -0.844 . . . . 74.42 109.501 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.469 ' HE2' ' HA3' ' A' ' 523' ' ' GLY . 13.3 tmtt? -109.44 106.65 16.49 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.466 -0.494 . . . . 73.4 110.311 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.08 38.31 20.36 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.164 -0.926 . . . . 73.3 111.808 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.73 -24.16 32.12 Favored Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.87 -0.681 . . . . 71.14 112.586 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.6 t -89.7 124.84 42.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 110.072 -0.344 . . . . 74.04 110.072 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -89.62 119.66 30.24 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.428 -0.582 . . . . 64.24 109.428 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.436 HD11 ' HB2' ' A' ' 486' ' ' TRP . 2.4 pp -72.73 161.64 30.49 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.199 -0.455 . . . . 65.12 111.395 -177.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' THR . . . . . 0.485 ' O ' ' HB2' ' A' ' 497' ' ' GLU . 19.1 m -106.85 142.72 36.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.98 -0.554 . . . . 75.42 110.241 -178.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . 0.414 ' HD3' ' C ' ' A' ' 495' ' ' ARG . 4.3 tmt_? -65.19 -39.91 93.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.345 -0.613 . . . . 75.45 109.345 176.308 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.25 73.14 3.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.936 -0.575 . . . . 64.11 109.898 171.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . 0.485 ' HB2' ' O ' ' A' ' 494' ' ' THR . 5.0 tp10 -120.21 179.58 4.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.585 -0.734 . . . . 75.23 109.44 -177.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' THR . . . . . 0.438 ' H ' ' HG3' ' A' ' 497' ' ' GLU . 11.2 t -72.5 172.64 10.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.703 0.287 . . . . 72.55 110.345 175.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -79.13 18.21 0.68 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.816 0.341 . . . . 72.41 111.791 -173.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . 0.588 ' HZ1' ' CG ' ' A' ' 521' ' ' ASP . 80.6 tttt -61.4 -35.13 76.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 73.54 111.189 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.518 ' HD2' HD12 ' A' ' 512' ' ' LEU . 25.1 p90 -148.57 150.2 32.92 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.297 -0.411 . . . . 74.3 110.616 -177.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -146.6 142.64 28.16 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.479 -0.563 . . . . 74.34 109.479 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . 0.481 ' HB3' HD13 ' A' ' 512' ' ' LEU . 44.1 p90 -123.3 150.03 44.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.131 0.491 . . . . 74.33 111.34 -176.273 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -127.92 139.7 52.44 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.368 -0.833 . . . . 74.11 110.023 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.2 pptp? -111.07 137.78 48.3 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.691 -0.485 . . . . 75.43 109.691 173.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . 0.613 ' HB3' ' HB2' ' A' ' 509' ' ' ARG . 33.8 t70 -130.45 82.86 2.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.784 -0.644 . . . . 75.25 109.382 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.34 -107.99 2.25 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.704 -0.76 . . . . 65.34 111.661 -174.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . 0.437 ' O ' HG23 ' A' ' 477' ' ' VAL . 15.9 pt20 -89.32 -7.44 55.33 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.454 0.645 . . . . 74.11 110.151 177.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.613 ' HB2' ' HB3' ' A' ' 506' ' ' ASP . 67.8 mtp180 -91.08 147.12 23.29 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.641 -0.709 . . . . 71.44 111.071 -172.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -141.72 115.72 9.29 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.36 -0.607 . . . . 75.32 109.36 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -124.33 122.51 37.91 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.68 0.276 . . . . 71.41 110.574 -175.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.518 HD12 ' HD2' ' A' ' 501' ' ' TYR . 57.4 tp -107.86 126.54 52.79 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.137 -0.483 . . . . 61.03 110.315 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.426 ' N ' HD13 ' A' ' 513' ' ' ILE . 4.2 mp -108.76 113.84 45.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 120.954 0.406 . . . . 73.44 110.737 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . . . . . . . . . 35.5 mm -91.36 121.84 42.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.874 -0.787 . . . . 72.41 108.874 174.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . 0.434 ' N ' HD21 ' A' ' 515' ' ' ASN . 0.9 OUTLIER -66.64 -51.49 55.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.81 0.338 . . . . 72.24 110.397 -177.769 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . 0.447 ' HB3' ' HA2' ' A' ' 468' ' ' GLY . 46.4 mt-10 -145.4 123.55 12.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.917 -0.583 . . . . 74.44 110.131 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -66.48 133.71 50.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.128 -0.487 . . . . 74.13 110.999 178.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' MET . . . . . 0.404 ' HG2' ' H ' ' A' ' 520' ' ' GLU . 55.1 ttm -113.67 155.96 24.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.891 -0.595 . . . . 75.44 109.621 -178.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . 0.689 HD22 ' HB3' ' A' ' 542' ' ' GLU . 84.8 mt -58.81 -32.5 69.43 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.935 0.397 . . . . 62.43 111.623 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . 0.404 ' H ' ' HG2' ' A' ' 518' ' ' MET . 0.9 OUTLIER -60.41 -28.58 68.37 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.143 0.497 . . . . 74.01 110.691 178.454 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . 0.588 ' CG ' ' HZ1' ' A' ' 500' ' ' LYS . 56.7 m-20 -71.32 -11.95 61.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.767 -0.651 . . . . 74.43 112.197 -175.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.48 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -61.66 5.54 0.08 Allowed 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.576 0.584 . . . . 72.02 112.576 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . 0.501 ' H ' ' C ' ' A' ' 521' ' ' ASP . . . -83.91 170.56 47.81 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 116.415 -0.357 . . . . 72.11 112.367 177.081 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 44.4 m-70 -73.69 118.56 16.79 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 122.65 -0.324 . . . . 72.21 110.559 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . 0.434 ' HB2' ' O ' ' A' ' 536' ' ' ALA . 56.8 m-85 -83.75 133.73 34.77 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.957 -0.386 . . . . 74.33 109.957 172.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.57 134.23 46.84 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.867 0.365 . . . . 70.14 110.514 175.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.515 HD13 ' HB ' ' A' ' 484' ' ' VAL . 57.1 tp -110.33 106.52 15.93 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.866 -0.606 . . . . 72.4 109.939 177.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . 0.532 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 48.7 m -92.52 115.11 27.8 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.218 -0.446 . . . . 74.43 110.113 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.525 HG21 HG13 ' A' ' 484' ' ' VAL . 44.3 p -109.11 -175.01 2.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.909 0.385 . . . . 73.54 110.601 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 14.5 m -72.65 -5.92 40.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.082 -0.508 . . . . 74.32 110.965 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -138.43 -90.38 0.22 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.653 -0.784 . . . . 75.22 112.785 -178.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -97.46 127.28 9.16 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.631 -0.795 . . . . 73.54 112.455 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -95.55 127.1 41.31 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.059 0.457 . . . . 71.14 110.814 178.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -97.23 140.03 32.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.006 -0.543 . . . . 72.41 110.044 178.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 6.0 tt -129.58 123.78 32.18 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.724 -0.473 . . . . 75.3 109.724 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 525' ' ' TYR . . . -145.07 134.76 23.43 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.724 -0.671 . . . . 74.4 109.687 177.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -105.17 137.72 42.5 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 120.844 0.354 . . . . 73.02 110.474 -176.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' ' 522' ' ' ALA . 45.4 tp -96.4 133.95 40.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.879 -0.601 . . . . 74.23 110.201 -174.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.824 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 7.6 mt -104.06 123.78 58.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.98 -0.748 . . . . 63.43 108.98 177.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 45.6 t -118.74 126.37 75.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.584 -0.28 . . . . 75.11 111.22 -174.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . 0.554 ' HG3' ' CD2' ' A' ' 464' ' ' LEU . 74.8 mt-30 -84.82 127.73 34.28 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 116.361 -0.381 . . . . 73.13 111.189 175.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . 0.689 ' HB3' HD22 ' A' ' 519' ' ' LEU . 6.9 pt-20 -91.12 126.81 36.32 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.512 -1.292 . . . . 74.22 107.512 163.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp . . . . . 0 C--N 1.315 -0.92 0 CA-C-O 118.865 -0.588 . . . . 74.35 109.736 -176.609 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 111.361 -0.696 . . . . 70.15 111.361 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 17.3 m -78.95 140.37 38.05 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.619 -0.512 . . . . 75.23 109.619 176.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.32 146.06 53.63 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.747 -0.381 . . . . 71.33 110.31 -179.308 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 66.4 mtt -63.92 154.26 82.0 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.059 -0.519 . . . . 73.2 110.141 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.53 148.03 21.52 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.812 2.341 . . . . 71.21 111.794 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.4 ' H ' ' HA3' ' A' ' 531' ' ' GLY . 43.1 t -66.26 106.34 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.112 -0.494 . . . . 63.41 110.219 -177.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 93.6 mt -82.57 147.29 28.7 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.605 -0.725 . . . . 73.41 110.163 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . 0.786 HG13 ' HB1' ' A' ' 534' ' ' ALA . 40.7 mm -94.79 117.35 38.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.942 -0.572 . . . . 73.41 109.908 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' THR . . . . . 0.488 HG22 ' NH2' ' A' ' 458' ' ' ARG . 3.3 m -83.28 -35.63 25.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.218 -0.447 . . . . 73.3 110.583 -177.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.685 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 14.2 mmp_? -115.42 105.57 52.04 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 109.566 -0.531 . . . . 74.43 109.566 176.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -70.75 160.61 48.85 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.784 2.323 . . . . 71.23 111.785 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.466 ' HB2' ' CB ' ' A' ' 536' ' ' ALA . 94.8 mt -81.77 169.4 16.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.763 0.316 . . . . 65.33 110.98 -177.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -64.7 118.12 8.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.961 -0.563 . . . . 55.21 111.444 -175.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -94.76 -11.75 28.43 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.865 -0.607 . . . . 72.42 111.503 177.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -89.51 159.73 17.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.196 0.522 . . . . 74.24 111.778 -171.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 8.4 tt -85.81 137.06 33.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.51 -0.768 . . . . 74.32 110.258 -173.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.573 HG22 HG21 ' A' ' 540' ' ' VAL . 22.8 m -130.45 175.99 9.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.623 -0.717 . . . . 64.44 110.476 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' MET . . . . . 0.485 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 65.8 mtt -111.21 150.74 29.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.638 0.256 . . . . 73.11 110.975 -178.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.5 142.56 16.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.303 -0.408 . . . . 74.04 110.72 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.06 -25.49 28.12 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.946 -0.645 . . . . 74.24 113.635 175.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 466' ' ' MET . 13.1 pt20 -89.26 164.82 14.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.25 0.525 . . . . 71.55 110.444 -178.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . 0.51 ' HG3' ' O ' ' A' ' 514' ' ' ILE . 33.9 ttm180 -88.81 129.39 35.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.909 0.385 . . . . 74.44 111.215 -174.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -124.92 139.92 49.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.495 . . . . 72.11 110.206 -177.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -125.69 134.12 51.93 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.753 0.311 . . . . 55.54 110.643 -178.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.749 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 81.8 m-85 -107.12 116.32 31.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.207 -0.451 . . . . 70.1 110.625 177.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -100.06 118.14 35.81 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.628 -0.715 . . . . 71.24 109.606 177.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.685 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 27.6 t -134.89 141.29 46.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.299 0.571 . . . . 72.32 111.305 -178.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.612 ' HG3' ' HG2' ' A' ' 509' ' ' ARG . 42.7 tt0 -138.45 136.85 36.62 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.298 -1.001 . . . . 74.43 108.298 176.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.505 HG23 ' HB1' ' A' ' 482' ' ' ALA . 18.0 m -104.07 154.68 5.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 C-N-CA 121.167 -0.213 . . . . 64.22 110.459 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 45.4 m -82.61 -2.22 53.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.814 0.34 . . . . 75.42 111.622 -178.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -111.21 141.29 44.92 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.612 -0.514 . . . . 73.14 109.612 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -86.24 138.41 31.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.153 -0.476 . . . . 74.42 111.202 -173.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 62.13 39.1 97.2 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.922 -0.656 . . . . 73.31 112.212 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.505 ' HB1' HG23 ' A' ' 477' ' ' VAL . . . -103.34 112.03 24.72 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.078 0.466 . . . . 71.14 111.065 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -73.31 154.31 40.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.594 -0.73 . . . . 75.42 109.594 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.409 HG13 HG23 ' A' ' 529' ' ' THR . 35.7 m -124.63 161.26 28.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.897 0.379 . . . . 72.55 111.022 -175.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' A' ' 527' ' ' LEU . 12.3 ttmm -116.64 128.77 55.69 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.731 -0.668 . . . . 72.3 109.682 177.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 89.9 m95 -98.82 115.35 28.61 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.306 -0.627 . . . . 75.53 109.306 175.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 28.6 tp -119.6 119.2 33.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.032 -0.531 . . . . 73.4 110.393 -177.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.471 ' O ' ' HD3' ' A' ' 488' ' ' LYS . 13.3 tmtt? -109.74 106.79 16.56 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.013 -0.366 . . . . 71.33 110.013 177.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.1 t70 49.19 38.46 13.32 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.461 0.648 . . . . 74.21 111.491 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.45 -17.21 58.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.707 -0.759 . . . . 64.12 113.014 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.6 t -84.89 117.14 29.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.803 0.302 . . . . 74.34 110.729 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -97.89 117.67 32.75 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.44 -0.578 . . . . 74.53 109.44 176.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.9 pp -73.97 163.11 28.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.177 0.513 . . . . 73.54 112.008 -175.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 34.9 p -106.72 174.42 5.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.619 -0.719 . . . . 72.24 111.541 -177.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -63.14 -47.47 82.58 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.324 0.583 . . . . 75.22 111.202 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -95.52 50.51 1.24 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.824 -0.625 . . . . 74.33 110.23 -176.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -76.45 169.75 17.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.905 -0.589 . . . . 72.32 110.649 -176.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 4.7 t -57.75 150.97 18.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.155 0.502 . . . . 55.51 111.898 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -85.19 7.21 22.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.862 -0.608 . . . . 72.12 111.123 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . 0.48 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 54.3 tptt -62.06 -37.34 84.63 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.483 0.659 . . . . 75.0 109.337 174.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.485 ' HB2' HG12 ' A' ' 514' ' ' ILE . 8.4 p90 -152.19 131.64 12.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.954 -1.021 . . . . 71.54 108.681 175.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -139.0 161.51 37.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.096 0.474 . . . . 72.12 111.755 -175.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -119.0 139.64 51.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.834 -0.621 . . . . 70.35 110.755 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.421 ' HE2' ' HB3' ' A' ' 504' ' ' LYS . 40.7 mtpt -127.59 149.69 50.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.11 -0.495 . . . . 75.11 109.921 176.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.458 ' O ' ' HD3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -106.62 146.9 30.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.2 0.524 . . . . 73.32 111.478 -176.108 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -147.31 99.07 3.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.361 -0.836 . . . . 63.01 109.546 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 61.83 -123.65 32.16 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.453 -0.88 . . . . 64.33 111.107 -173.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -96.92 7.34 46.85 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.172 0.51 . . . . 74.43 110.423 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.612 ' HG2' ' HG3' ' A' ' 476' ' ' GLU . 74.8 mtm180 -95.26 152.29 18.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.044 -0.525 . . . . 62.13 110.032 177.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -136.94 128.25 28.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.966 -0.383 . . . . 63.42 109.966 -178.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -111.01 123.91 51.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.515 -0.311 . . . . 63.5 110.198 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.749 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 58.2 tp -110.28 104.47 13.28 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.511 -0.551 . . . . 70.45 109.511 174.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.441 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.3 mp -101.38 115.55 43.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.239 -0.437 . . . . 73.0 110.515 -175.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.51 ' O ' ' HG3' ' A' ' 470' ' ' ARG . 51.8 mt -97.74 119.42 45.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.898 -0.779 . . . . 75.54 108.898 173.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -69.1 -39.56 78.9 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.366 -0.379 . . . . 73.23 110.88 -177.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . 0.48 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 41.4 mt-10 -146.83 113.17 5.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.908 -0.587 . . . . 73.01 109.617 178.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -58.43 143.23 46.08 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 123.517 0.511 . . . . 71.14 111.385 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 88.0 mtp -123.38 172.9 8.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.102 -0.499 . . . . 64.02 110.301 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . 0.476 HD11 ' O ' ' A' ' 519' ' ' LEU . 2.6 tm? -60.7 -31.36 70.64 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.956 -0.387 . . . . 72.34 109.956 177.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -52.44 -28.62 20.76 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.073 -0.512 . . . . 71.13 111.87 177.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . 0.543 ' HA ' ' HE1' ' A' ' 525' ' ' TYR . 42.6 m-20 -68.16 -15.38 63.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.379 -0.373 . . . . 73.03 111.802 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.491 ' HB2' HG13 ' A' ' 540' ' ' VAL . . . -71.04 -12.86 61.76 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.13 0.49 . . . . 73.3 110.225 174.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -77.66 156.53 44.6 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 111.138 -0.785 . . . . 30.53 111.138 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -81.79 117.19 21.89 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.189 0.518 . . . . 64.52 111.044 -176.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . 0.543 ' HE1' ' HA ' ' A' ' 521' ' ' ASP . 73.4 m-85 -88.96 133.76 34.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.205 -0.907 . . . . 74.24 110.667 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -123.59 135.02 53.74 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.081 -0.509 . . . . 73.25 110.36 176.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.417 ' HA ' ' O ' ' A' ' 485' ' ' LYS . 9.4 tt -109.8 111.0 22.17 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.883 -0.784 . . . . 74.13 108.883 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 42.1 t -109.5 136.31 49.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.29 -0.414 . . . . 71.51 110.721 -176.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.409 HG23 HG13 ' A' ' 484' ' ' VAL . 82.3 p -118.22 -175.65 2.9 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.69 -0.485 . . . . 73.4 109.69 175.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 13.7 m -69.18 -9.08 51.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.761 0.315 . . . . 74.32 110.942 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . 0.4 ' HA3' ' H ' ' A' ' 454' ' ' VAL . . . -124.85 -65.97 0.19 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.395 -0.907 . . . . 75.22 112.896 -177.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -113.52 171.45 13.84 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.676 -0.773 . . . . 70.11 112.498 -176.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -138.62 130.34 27.78 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.775 0.321 . . . . 74.21 110.561 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . 0.786 ' HB1' HG13 ' A' ' 456' ' ' ILE . . . -109.47 120.97 44.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.209 -0.451 . . . . 74.44 110.157 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 5.3 tt -109.05 121.2 44.64 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.093 -0.706 . . . . 75.22 109.093 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.466 ' CB ' ' HB2' ' A' ' 460' ' ' LEU . . . -119.2 132.13 55.91 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.065 0.46 . . . . 73.33 110.478 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -99.46 108.73 21.26 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.38 0.61 . . . . 73.43 109.691 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.416 HD23 ' HB3' ' A' ' 521' ' ' ASP . 37.0 tp -97.78 136.1 38.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.331 -0.85 . . . . 75.2 109.459 -177.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 31.5 mt -113.03 112.36 40.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.84 -0.43 . . . . 73.42 109.84 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.573 HG21 HG22 ' A' ' 465' ' ' VAL . 4.4 p -113.91 133.34 60.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 108.803 -0.814 . . . . 73.25 108.803 176.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -110.21 148.18 32.34 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.107 0.479 . . . . 73.4 111.407 -176.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.36 146.97 50.1 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.012 -0.994 . . . . 70.02 110.786 -178.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.437 ' HD2' ' HB3' ' A' ' 466' ' ' MET . 55.9 mtpt . . . . . 0 C--O 1.244 0.803 0 CA-C-O 118.629 -0.7 . . . . 73.44 109.323 175.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.652 0 N-CA-C 111.78 -0.528 . . . . 52.11 111.78 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 11.4 t -122.65 153.7 39.01 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.786 -0.45 . . . . 70.31 109.786 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -78.07 69.22 4.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.15 0.5 . . . . 74.1 110.047 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 17.6 tpt -98.54 117.45 64.61 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 115.681 -0.69 . . . . 74.44 109.943 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.48 147.19 87.39 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.781 2.321 . . . . 72.25 112.068 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.68 132.35 32.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.991 -0.55 . . . . 74.11 110.674 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.9 137.26 34.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.922 -0.581 . . . . 73.52 110.857 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . 0.559 HD11 HG13 ' A' ' 477' ' ' VAL . 32.9 mm -95.43 119.08 43.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.734 -0.666 . . . . 73.34 109.717 177.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' THR . . . . . 0.766 ' HB ' ' HG3' ' A' ' 476' ' ' GLU . 7.5 m -86.89 -23.54 25.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 73.21 111.18 -177.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.797 ' HG2' ' HG2' ' A' ' 476' ' ' GLU . 22.5 mmt180 -123.35 117.32 28.04 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.598 -0.274 . . . . 70.34 111.671 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -83.42 167.12 13.71 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 123.02 2.48 . . . . 75.42 111.414 173.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -89.49 169.96 10.92 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.617 0.246 . . . . 55.13 110.87 -178.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -71.18 118.64 14.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.275 -0.42 . . . . 74.43 110.453 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -93.94 -13.47 27.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.171 -0.468 . . . . 74.24 111.27 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -89.66 155.32 19.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.136 0.493 . . . . 62.01 111.131 -173.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 8.0 tt -88.95 133.13 34.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.708 -0.678 . . . . 74.31 110.352 -173.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 28.7 m -127.49 176.67 6.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 63.21 111.035 -177.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 26.4 mmt -113.86 152.91 30.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.323 -0.399 . . . . 75.41 111.272 -176.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 517' ' ' ALA . 83.1 t -68.14 144.69 14.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.549 -0.751 . . . . 71.01 110.787 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.52 -2.26 53.39 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.911 -0.661 . . . . 54.2 113.973 175.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -114.57 164.34 14.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.471 0.636 . . . . 74.04 110.475 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 27.2 ttt85 -84.92 132.88 34.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.975 0.417 . . . . 74.54 111.166 -177.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.489 ' O ' ' HB ' ' A' ' 514' ' ' ILE . 50.5 t -131.67 138.57 52.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.862 -0.608 . . . . 61.13 109.605 177.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -131.78 139.44 48.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.778 0.323 . . . . 64.22 110.461 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 93.5 m-85 -121.27 109.61 15.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.929 -0.578 . . . . 64.41 110.154 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -106.43 117.09 33.13 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 119.909 -0.716 . . . . 70.04 109.467 173.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.74 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 7.7 p -122.8 123.41 40.98 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.555 -0.748 . . . . 62.11 109.974 -178.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.797 ' HG2' ' HG2' ' A' ' 458' ' ' ARG . 13.3 pt-20 -125.42 145.09 50.22 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.909 0.385 . . . . 74.43 110.239 -177.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.559 HG13 HD11 ' A' ' 456' ' ' ILE . 17.9 m -111.49 164.63 7.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.782 -0.645 . . . . 73.43 109.543 178.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 15.6 t -78.16 -18.0 56.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.728 0.299 . . . . 74.14 111.214 -178.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . 0.433 ' O ' HG23 ' A' ' 477' ' ' VAL . 44.6 tt0 -103.31 131.94 49.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.817 0.341 . . . . 72.14 110.422 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . 0.498 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 43.2 tt0 -89.17 131.56 35.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.854 0.359 . . . . 73.5 110.164 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 98.78 -1.42 58.14 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.801 -0.714 . . . . 75.12 111.523 -176.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.505 ' HB3' HG22 ' A' ' 477' ' ' VAL . . . -79.57 112.01 16.41 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.055 0.455 . . . . 74.33 110.625 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -81.78 147.15 29.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.647 -0.706 . . . . 75.25 110.805 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 28.9 m -126.96 153.24 35.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.006 -0.543 . . . . 65.5 110.459 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -119.23 145.72 45.82 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.644 -0.502 . . . . 71.23 109.644 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -98.6 129.37 45.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.305 0.574 . . . . 74.51 110.909 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . 0.626 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 2.6 tm? -116.24 131.73 56.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.277 -0.874 . . . . 75.33 108.846 -177.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.429 ' HE3' ' HA3' ' A' ' 523' ' ' GLY . 1.2 tmtp? -120.55 107.32 12.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.898 0.38 . . . . 73.5 111.446 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 53.72 37.72 26.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.379 -0.828 . . . . 73.53 111.993 172.062 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.99 -24.04 33.01 Favored Glycine 0 CA--C 1.517 0.196 0 C-N-CA 120.751 -0.738 . . . . 63.14 112.553 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.9 t -97.28 127.87 49.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.725 0.298 . . . . 44.32 110.417 -178.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -86.65 131.85 34.04 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.82 -0.437 . . . . 72.51 109.82 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 3.3 pp -112.14 162.96 14.86 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.072 0.463 . . . . 71.33 111.256 -177.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 22.2 p -108.19 173.91 6.11 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.906 -0.588 . . . . 75.32 109.701 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . 0.63 ' HD3' ' CE2' ' A' ' 503' ' ' PHE . 13.9 tpt180 -80.9 -4.41 54.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.077 0.465 . . . . 75.13 110.467 -178.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -74.07 75.69 1.74 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.193 0.52 . . . . 75.13 110.48 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -145.47 170.7 15.87 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.824 -0.625 . . . . 74.41 109.482 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 15.2 t -68.65 172.12 6.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.086 0.47 . . . . 74.43 111.235 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -84.7 18.53 2.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 75.45 111.931 -172.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . 0.535 ' HZ2' ' CG ' ' A' ' 521' ' ' ASP . 13.8 tmtt? -58.09 -32.43 68.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.464 0.649 . . . . 72.11 109.785 174.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.61 ' HD2' HD11 ' A' ' 512' ' ' LEU . 23.0 p90 -144.44 144.11 31.23 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.467 -0.788 . . . . 72.44 109.153 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 22.2 p-90 -147.33 145.44 29.33 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.384 -0.371 . . . . 72.35 110.001 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . 0.63 ' CE2' ' HD3' ' A' ' 495' ' ' ARG . 44.9 p90 -126.87 151.99 47.64 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.327 -0.549 . . . . 64.32 111.651 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.618 ' HZ1' ' HB3' ' A' ' 504' ' ' LYS . 8.9 mtpm? -116.23 150.11 38.07 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.344 -0.844 . . . . 74.32 110.785 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.498 ' O ' ' HG3' ' A' ' 505' ' ' LYS . 18.5 ptpt -110.62 106.93 16.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.283 0.563 . . . . 74.54 109.804 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . 0.544 ' HB2' ' HG3' ' A' ' 509' ' ' ARG . 5.5 m-20 -113.82 80.3 1.36 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.23 0.538 . . . . 73.51 109.883 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.73 -96.7 0.38 Allowed Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.579 -0.737 . . . . 74.41 112.495 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . 0.498 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 19.2 pt20 -108.09 -10.83 15.39 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.918 0.39 . . . . 73.34 111.365 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.544 ' HG3' ' HB2' ' A' ' 506' ' ' ASP . 5.2 ptp180 -102.74 136.3 42.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.112 0.482 . . . . 74.25 110.528 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 -120.51 122.26 40.24 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.345 -0.613 . . . . 74.43 109.345 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . 0.493 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 12.8 m-70 -109.95 121.64 45.72 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 121.141 -0.223 . . . . 72.2 110.604 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.61 HD11 ' HD2' ' A' ' 501' ' ' TYR . 67.9 tp -106.93 110.62 22.82 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.45 -0.574 . . . . 74.51 109.45 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.41 ' N ' HD13 ' A' ' 513' ' ' ILE . 4.1 mp -100.84 119.85 49.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.238 -0.437 . . . . 75.52 110.145 -178.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.489 ' HB ' ' O ' ' A' ' 471' ' ' VAL . 69.0 mt -106.91 121.27 59.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.395 -0.594 . . . . 74.44 109.395 174.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -64.96 -51.65 60.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.172 -0.467 . . . . 74.03 110.227 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . 0.414 ' O ' ' HE2' ' A' ' 500' ' ' LYS . 42.0 mt-10 -139.39 129.7 25.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.986 -0.552 . . . . 75.44 110.157 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . 0.419 ' O ' HG13 ' A' ' 467' ' ' VAL . . . -64.04 132.44 50.57 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.966 -0.383 . . . . 71.11 109.966 175.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 49.7 ttm -128.6 171.85 11.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.926 -0.579 . . . . 75.24 109.625 -174.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 9.4 mp -54.87 -31.77 60.07 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.188 0.44 . . . . 73.34 112.188 -178.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -65.33 -21.45 66.7 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.485 0.55 . . . . 75.44 112.485 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . 0.535 ' CG ' ' HZ2' ' A' ' 500' ' ' LYS . 40.4 m-20 -75.39 -14.56 60.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.888 0.375 . . . . 72.31 110.938 -178.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -64.4 -20.97 66.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.2 -0.455 . . . . 53.23 109.935 173.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . 0.429 ' HA3' ' HE3' ' A' ' 488' ' ' LYS . . . -66.06 120.65 16.65 Favored Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 110.825 -0.91 . . . . 51.34 110.825 173.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -64.09 106.93 1.15 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.089 0.471 . . . . 64.33 110.956 -172.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . 0.409 ' HA ' ' O ' ' A' ' 487' ' ' LEU . 96.9 m-85 -75.09 135.03 41.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.416 -0.811 . . . . 75.44 111.459 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.626 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -126.07 139.57 53.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.559 -0.746 . . . . 75.15 109.678 175.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 37.5 tp -97.97 107.1 19.51 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.894 -0.409 . . . . 71.1 109.894 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 53.2 m -91.7 114.01 26.43 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.17 -0.468 . . . . 71.42 110.368 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 3.2 m -119.2 163.4 17.14 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.872 -0.604 . . . . 73.44 109.915 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 26.0 t -72.64 -5.29 36.42 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 111.769 0.285 . . . . 64.44 111.769 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -119.83 -105.7 2.11 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.562 -0.828 . . . . 75.25 111.701 177.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -91.02 124.24 7.47 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.902 -0.879 . . . . 75.52 110.902 174.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.13 141.57 28.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.952 0.406 . . . . 74.15 110.241 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -103.62 125.11 49.93 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.115 -0.493 . . . . 74.12 110.365 -178.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 5.2 tt -128.34 121.43 29.15 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.25 0.548 . . . . 74.23 110.294 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -135.0 141.26 46.17 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.458 -0.942 . . . . 74.42 108.458 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -96.43 109.7 22.19 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.044 0.926 . . . . 75.34 110.543 -174.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 54.8 tp -95.76 136.75 35.78 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.641 -1.163 . . . . 64.45 109.733 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.449 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 55.8 mt -126.08 118.87 52.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.992 -0.549 . . . . 72.31 109.649 177.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 40.9 t -114.44 105.41 18.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 109.699 -0.482 . . . . 74.44 109.699 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -87.36 139.29 30.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.852 -0.613 . . . . 75.31 110.864 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.47 155.99 20.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.456 -0.793 . . . . 73.52 110.679 -178.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.411 ' HE3' ' HB3' ' A' ' 543' ' ' LYS . 26.3 mtpp . . . . . 0 C--O 1.248 1.011 0 CA-C-N 115.904 -0.589 . . . . 73.54 109.673 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.81 0 N-CA-C 111.786 -0.526 . . . . 64.31 111.786 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 3.1 p -139.09 141.89 38.13 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.114 -0.328 . . . . 74.22 110.114 177.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 -77.82 92.07 4.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.156 0.503 . . . . 70.21 110.311 -178.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 24.3 mmt -116.91 157.34 46.65 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 115.473 -0.785 . . . . 71.32 110.013 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . 0.462 ' O ' HD21 ' A' ' 455' ' ' LEU . 35.1 Cg_exo -62.07 164.36 17.15 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.596 2.198 . . . . 73.52 110.931 172.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 56.5 t -65.98 113.32 2.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.932 -0.307 . . . . 75.12 110.341 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . 0.462 HD21 ' O ' ' A' ' 453' ' ' PRO . 2.6 mm? -78.62 125.22 29.07 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.113 -0.494 . . . . 72.23 111.084 -176.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 36.5 mm -81.96 106.34 12.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.064 -0.717 . . . . 64.34 109.064 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 86.1 m -62.02 -39.54 92.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.105 -0.498 . . . . 74.33 111.491 -175.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -128.63 121.84 21.36 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.445 -0.343 . . . . 73.22 110.532 -179.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.49 167.88 23.64 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.932 2.422 . . . . 70.4 112.398 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . 0.465 ' HB2' ' HB1' ' A' ' 536' ' ' ALA . 97.0 mt -80.89 147.38 30.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 74.44 110.586 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -55.67 122.25 10.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.451 -0.795 . . . . 64.15 111.721 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -93.18 -11.09 33.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.238 -0.892 . . . . 63.4 112.054 -176.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -88.05 157.42 18.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.473 0.654 . . . . 74.11 111.882 -169.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 9.0 tt -86.84 142.3 28.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.016 -0.993 . . . . 72.03 110.534 -173.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 27.7 m -130.18 178.17 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 CA-C-N 115.936 -0.575 . . . . 72.5 110.823 -178.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 21.0 ptp -127.24 160.28 31.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.965 0.412 . . . . 75.33 111.531 -178.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.63 146.25 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.188 -0.914 . . . . 74.24 112.45 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 102.02 -7.79 55.2 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 121.084 -0.579 . . . . 72.52 114.136 171.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -112.51 167.71 10.23 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 122.268 -0.548 . . . . 71.54 110.323 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.98 141.34 29.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.976 -0.749 . . . . 65.31 108.976 176.617 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.722 HG21 ' HB ' ' A' ' 514' ' ' ILE . 6.8 m -127.96 123.38 60.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 121.294 0.569 . . . . 54.01 110.01 176.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -121.93 123.96 42.94 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.303 0.573 . . . . 73.15 110.577 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -114.06 132.67 55.94 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.234 -0.894 . . . . 75.11 109.615 -175.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -120.32 116.91 26.47 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.46 -0.496 . . . . 73.12 110.669 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.648 ' O ' ' HB2' ' A' ' 510' ' ' HIS . 5.9 p -139.26 110.95 7.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.726 -0.67 . . . . 65.41 109.974 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.589 ' HB3' ' H ' ' A' ' 510' ' ' HIS . 0.6 OUTLIER -128.92 163.27 25.66 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.238 -0.437 . . . . 74.44 110.343 -178.644 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.498 HG23 ' HB1' ' A' ' 482' ' ' ALA . 17.7 m -113.67 171.91 3.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.25 -0.432 . . . . 72.21 110.874 -173.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 20.2 t -88.79 -22.28 23.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.043 -0.526 . . . . 70.45 110.854 -177.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -96.75 132.51 42.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.632 -0.507 . . . . 75.24 109.632 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . 0.645 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 11.4 pt-20 -87.47 137.54 32.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.108 0.48 . . . . 74.31 111.012 -175.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 95.58 -6.97 68.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.831 -0.699 . . . . 71.21 111.959 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.498 ' HB1' HG23 ' A' ' 477' ' ' VAL . . . -77.97 110.71 13.14 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.121 0.486 . . . . 74.3 110.187 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -92.8 164.88 13.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.822 -0.626 . . . . 70.44 110.508 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.473 HG12 HG23 ' A' ' 529' ' ' THR . 35.5 m -135.95 154.82 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.208 -0.451 . . . . 71.31 110.345 -178.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -117.42 138.71 51.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.769 -0.456 . . . . 74.5 109.769 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . 0.528 ' HB2' HD21 ' A' ' 493' ' ' LEU . 87.6 m95 -99.34 138.12 36.87 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.045 0.45 . . . . 72.0 111.217 -176.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . 0.597 ' HB3' ' HB2' ' A' ' 526' ' ' ALA . 34.5 tp -121.84 128.99 52.27 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.259 -0.645 . . . . 74.55 109.259 176.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -112.36 106.68 15.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.004 0.431 . . . . 74.53 110.909 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.1 t70 53.63 36.82 24.56 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.447 -0.797 . . . . 73.34 111.625 174.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 94.15 -21.02 44.49 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.771 -0.728 . . . . 72.04 112.669 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 61.6 t -99.77 133.07 43.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 110.099 -0.334 . . . . 74.32 110.099 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -78.81 125.61 29.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.868 -0.79 . . . . 74.34 108.868 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.528 HD21 ' HB2' ' A' ' 486' ' ' TRP . 3.2 pp -68.73 161.82 27.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.382 0.61 . . . . 73.22 112.098 -170.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 6.6 t -107.4 172.88 6.58 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.126 -0.943 . . . . 64.51 110.903 -172.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -104.64 7.62 35.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.224 0.535 . . . . 75.11 110.274 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -62.11 -69.44 0.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.876 -0.602 . . . . 73.33 111.417 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . 0.521 ' OE2' ' HB2' ' A' ' 500' ' ' LYS . 25.7 tt0 -106.68 118.89 37.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.116 0.484 . . . . 72.32 110.477 178.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' THR . . . . . 0.585 HG21 ' HB3' ' A' ' 502' ' ' TRP . 3.9 m -111.27 11.69 21.7 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.629 0.728 . . . . 74.41 109.686 175.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . 0.438 ' H ' ' HG2' ' A' ' 497' ' ' GLU . 89.3 m-85 -83.81 -25.51 30.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.639 -0.71 . . . . 75.02 111.249 -176.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . 0.691 ' HB2' ' HZ1' ' A' ' 500' ' ' LYS . 4.6 ttmp? -69.69 -42.43 74.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.113 0.483 . . . . 72.44 110.017 177.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.482 ' CB ' HG12 ' A' ' 514' ' ' ILE . 7.5 p90 -159.0 142.2 14.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.499 -0.773 . . . . 65.24 110.164 -178.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' TRP . . . . . 0.585 ' HB3' HG21 ' A' ' 498' ' ' THR . 0.1 OUTLIER -140.78 145.59 36.55 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.201 -0.454 . . . . 75.4 110.991 178.478 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . 0.478 ' HB3' HD13 ' A' ' 512' ' ' LEU . 31.2 p90 -117.77 151.69 36.8 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.21 -0.45 . . . . 74.25 109.925 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -115.52 135.44 54.09 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.981 -0.554 . . . . 73.14 109.787 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 1.9 pptp? -104.49 132.71 50.42 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.856 -0.424 . . . . 72.52 109.856 172.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . 0.665 ' HB3' ' HB2' ' A' ' 509' ' ' ARG . 8.0 t70 -143.2 84.38 1.82 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.168 -0.469 . . . . 73.31 109.865 -177.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.31 -97.61 0.34 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.032 -0.604 . . . . 74.15 111.854 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . 0.645 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 19.1 pt20 -105.55 -7.69 18.46 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.328 0.585 . . . . 73.24 110.315 176.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.665 ' HB2' ' HB3' ' A' ' 506' ' ' ASP . 58.2 mtt180 -84.66 139.87 31.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.415 -0.811 . . . . 73.41 110.807 -175.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . 0.648 ' HB2' ' O ' ' A' ' 475' ' ' CYS . 95.2 m-70 -141.77 116.99 10.07 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.414 -0.587 . . . . 73.14 109.414 174.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 19.8 m-70 -125.75 122.88 37.5 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.93 -0.396 . . . . 75.35 109.93 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.478 HD13 ' HB3' ' A' ' 503' ' ' PHE . 54.0 tp -107.39 120.14 41.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.861 0.362 . . . . 54.43 110.513 -176.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 60.5 mt -115.06 114.51 46.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 116.504 -0.316 . . . . 61.33 110.556 -178.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.722 ' HB ' HG21 ' A' ' 471' ' ' VAL . 58.5 mt -100.59 119.86 49.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.196 0.522 . . . . 75.13 109.598 176.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -70.75 -37.71 73.44 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.359 -0.837 . . . . 64.45 111.935 -173.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -138.63 111.07 7.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.598 -0.274 . . . . 74.32 111.296 -177.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -67.29 122.35 17.69 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.679 -0.489 . . . . 64.43 109.679 173.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 93.9 mmm -135.04 175.21 9.79 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.886 -0.597 . . . . 74.31 110.548 -174.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.83 -33.76 74.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.858 0.361 . . . . 72.4 110.77 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -62.85 -26.56 68.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.224 0.535 . . . . 73.23 111.071 173.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -83.2 -14.89 52.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.423 -0.808 . . . . 73.35 110.151 -177.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -76.31 5.61 6.79 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.795 -0.638 . . . . 52.42 111.202 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -70.64 158.14 53.61 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.908 -0.663 . . . . 75.12 111.607 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -83.3 114.16 21.21 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 122.048 -0.678 . . . . 72.1 109.999 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -88.37 132.97 34.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.149 0.5 . . . . 74.21 111.503 -174.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.597 ' HB2' ' HB3' ' A' ' 487' ' ' LEU . . . -122.69 142.92 50.16 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.607 -0.724 . . . . 73.21 109.702 175.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.685 ' HB3' ' HB2' ' A' ' 534' ' ' ALA . 10.0 tt -121.13 117.92 28.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.986 0.422 . . . . 62.45 109.999 -176.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 55.9 m -99.23 124.02 43.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.01 -0.541 . . . . 72.21 110.482 -179.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.473 HG23 HG12 ' A' ' 484' ' ' VAL . 2.3 m -113.78 166.13 11.86 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.168 -0.308 . . . . 74.44 110.168 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 9.5 m -54.83 -36.32 64.89 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.807 0.337 . . . . 73.2 111.83 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -136.43 -6.77 1.79 Allowed Glycine 0 C--O 1.227 -0.304 0 C-N-CA 120.476 -0.869 . . . . 74.33 112.716 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . 0.402 ' H ' ' HB ' ' A' ' 529' ' ' THR . . . -115.34 173.27 14.64 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.828 -0.701 . . . . 73.45 112.266 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -146.68 137.63 24.08 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.917 -0.401 . . . . 74.55 109.917 177.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . 0.685 ' HB2' ' HB3' ' A' ' 527' ' ' LEU . . . -132.65 148.55 52.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.405 -0.361 . . . . 73.1 110.501 178.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 7.7 tt -144.62 131.28 20.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.609 -0.886 . . . . 74.53 108.609 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 460' ' ' LEU . . . -135.13 137.44 42.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.157 0.503 . . . . 72.54 110.757 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -99.68 109.09 21.58 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.994 -0.548 . . . . 75.03 109.846 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 52.7 tp -104.23 115.87 31.18 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.731 -0.668 . . . . 70.04 109.792 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.421 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 54.6 mt -105.65 112.37 38.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 109.769 -0.456 . . . . 74.24 109.769 177.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 36.3 t -102.97 102.37 13.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 116.043 -0.526 . . . . 71.51 109.75 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -85.36 145.74 27.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.029 -0.532 . . . . 73.42 111.145 -176.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -81.05 153.77 27.2 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.313 -0.625 . . . . 74.2 109.313 172.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.337 -0.839 . . . . 75.23 110.085 -178.099 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.684 0 N-CA-C 111.856 -0.498 . . . . 62.11 111.856 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 69.1 m -136.04 148.31 48.3 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.898 0.38 . . . . 74.1 110.958 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 15.7 m170 -68.6 129.79 40.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.92 -0.582 . . . . 73.31 110.504 177.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 20.2 ptp -70.81 152.58 95.09 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.965 -0.562 . . . . 73.34 110.064 177.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.64 150.63 87.88 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.44 2.093 . . . . 70.4 111.701 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.69 114.72 3.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.199 -0.455 . . . . 74.54 110.275 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 93.4 mt -78.98 142.95 36.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.856 -0.611 . . . . 71.22 110.995 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . 0.415 HD12 HG13 ' A' ' 477' ' ' VAL . 31.0 mm -96.84 119.24 44.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.617 -0.72 . . . . 43.22 109.93 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 31.6 p -92.45 -31.7 15.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.022 0.439 . . . . 74.31 111.597 -178.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.722 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 18.5 mmt180 -101.18 121.63 51.28 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.284 -0.417 . . . . 74.5 110.638 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -86.78 161.27 9.11 Favored 'Trans proline' 0 N--CA 1.45 -1.049 0 C-N-CA 122.077 1.851 . . . . 70.13 112.176 175.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -83.3 172.32 12.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.008 -0.542 . . . . 74.45 110.062 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . 0.847 ' HG3' HD13 ' A' ' 538' ' ' LEU . 4.7 pm0 -56.99 118.21 4.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.818 0.818 . . . . 73.14 112.856 -172.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -95.28 -19.1 20.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.48 -0.782 . . . . 75.03 110.302 172.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -92.16 154.72 18.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 75.23 111.605 -174.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.709 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 3.2 tt -90.12 134.86 34.01 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.021 -0.733 . . . . 73.03 109.021 176.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.536 ' N ' HD23 ' A' ' 464' ' ' LEU . 35.8 m -120.8 160.98 21.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.176 0.513 . . . . 73.41 111.778 -174.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' MET . . . . . 0.427 ' SD ' ' HD3' ' A' ' 543' ' ' LYS . 23.1 ptp -98.85 153.37 18.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 75.11 110.582 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . 0.447 ' CG1' ' HA ' ' A' ' 542' ' ' GLU . 14.3 p -69.01 145.21 13.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 74.04 111.246 177.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 100.5 -24.74 30.92 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.778 -0.725 . . . . 45.35 113.7 172.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 26.5 pt20 -85.81 162.0 18.86 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 117.191 0.496 . . . . 71.12 110.916 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -86.27 116.8 24.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.962 -0.563 . . . . 73.14 109.778 176.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 22.0 t -117.23 126.74 74.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 110.037 -0.357 . . . . 71.22 110.037 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.488 ' HG2' HG21 ' A' ' 513' ' ' ILE . 41.2 mt-10 -109.07 123.47 49.22 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.447 -0.342 . . . . 74.03 110.201 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.583 ' CE1' ' HB3' ' A' ' 461' ' ' GLU . 25.3 m-85 -106.85 109.08 20.89 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.415 -0.587 . . . . 73.44 109.415 177.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . 0.414 ' O ' ' HB3' ' A' ' 458' ' ' ARG . 29.5 mt-10 -106.58 116.73 32.44 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.701 -0.481 . . . . 73.44 109.701 -178.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.722 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 36.8 t -135.69 111.81 9.65 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.227 0.537 . . . . 75.44 110.07 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.605 ' HB3' ' H ' ' A' ' 510' ' ' HIS . 7.3 pt-20 -131.05 167.67 18.69 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.776 -0.647 . . . . 75.21 109.897 -176.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.54 HG23 ' HB3' ' A' ' 482' ' ' ALA . 20.9 m -115.06 166.94 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.932 0.396 . . . . 75.13 111.59 -172.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 41.2 t -86.34 -11.08 53.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.73 -0.668 . . . . 74.15 111.695 -176.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -116.22 139.72 50.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.903 0.382 . . . . 71.01 111.208 -175.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . 0.619 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 7.7 tp10 -75.49 146.83 40.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.65 -0.705 . . . . 74.12 110.79 -177.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 82.43 -8.76 60.58 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 116.018 -0.537 . . . . 73.04 112.977 177.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.54 ' HB3' HG23 ' A' ' 477' ' ' VAL . . . -74.72 116.26 15.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.418 0.627 . . . . 71.2 111.484 -176.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -82.31 156.05 24.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.115 -0.948 . . . . 75.42 110.327 178.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 26.8 m -129.27 154.36 40.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.322 -0.399 . . . . 73.41 110.726 -178.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . 0.505 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 57.3 tttp -118.49 134.93 54.69 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.871 -0.604 . . . . 64.53 110.076 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -98.23 122.06 40.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.069 0.461 . . . . 64.32 110.582 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 24.4 tp -120.12 125.35 48.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.654 -0.703 . . . . 64.52 109.53 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.532 ' HD2' HD23 ' A' ' 493' ' ' LEU . 26.1 tttp -101.65 103.65 14.46 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.762 -0.458 . . . . 64.23 109.762 -177.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.6 t0 45.81 38.23 4.16 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.781 0.832 . . . . 73.33 112.518 -179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 93.02 -4.75 75.17 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.542 -0.837 . . . . 60.41 112.711 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 54.3 t -99.85 127.32 52.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.947 -0.39 . . . . 71.21 109.947 176.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -72.95 124.56 25.69 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.066 -0.515 . . . . 73.11 110.598 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . 0.532 HD23 ' HD2' ' A' ' 488' ' ' LYS . 86.0 mt -76.49 148.54 37.11 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.135 -0.484 . . . . 75.45 110.787 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 7.8 t -93.48 165.47 12.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.901 -0.59 . . . . 73.51 110.771 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -65.61 -29.07 69.61 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.061 0.458 . . . . 73.51 110.677 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -108.77 80.77 1.37 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.3 0.572 . . . . 74.24 110.506 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -96.52 161.32 13.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.354 -0.839 . . . . 73.52 109.888 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 11.2 t -63.29 151.86 39.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.058 0.456 . . . . 62.3 110.962 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -85.23 16.97 3.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.098 -0.501 . . . . 75.35 111.12 -176.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . 0.683 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 33.3 tttp -71.66 -28.06 63.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.482 -0.562 . . . . 74.34 109.482 177.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.532 ' HB3' HG22 ' A' ' 514' ' ' ILE . 2.2 p90 -142.82 135.01 27.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.661 -0.7 . . . . 75.3 110.101 173.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' TRP . . . . . 0.467 ' CZ3' ' HE3' ' A' ' 504' ' ' LYS . 11.4 p-90 -139.17 166.51 24.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.513 -0.767 . . . . 75.02 109.705 -172.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -133.58 157.46 45.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.438 0.637 . . . . 73.41 112.403 -175.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.467 ' HE3' ' CZ3' ' A' ' 502' ' ' TRP . 99.7 mttt -118.21 150.73 38.93 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.549 -1.205 . . . . 73.33 108.913 174.564 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.4 pptp? -137.94 129.87 28.59 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.348 0.594 . . . . 73.31 111.208 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . 0.637 ' HB2' ' HB2' ' A' ' 509' ' ' ARG . 26.9 m-20 -119.56 79.5 1.44 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.58 -0.896 . . . . 54.54 108.58 173.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 60.33 -104.44 0.62 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.92 -0.657 . . . . 74.53 112.402 -175.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . 0.619 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 20.7 pt20 -80.39 -16.38 54.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.995 0.426 . . . . 75.12 110.734 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.637 ' HB2' ' HB2' ' A' ' 506' ' ' ASP . 84.8 mtt180 -84.71 132.02 34.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.126 -0.488 . . . . 75.4 110.12 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . 0.605 ' H ' ' HB3' ' A' ' 476' ' ' GLU . 77.9 m-70 -136.14 117.11 14.25 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.38 -0.6 . . . . 72.44 109.38 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -125.63 121.71 34.32 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 121.034 -0.266 . . . . 62.41 110.498 -175.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . 0.402 ' HB3' ' O ' ' A' ' 473' ' ' PHE . 37.7 tp -103.61 133.11 49.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.717 0.294 . . . . 64.53 110.435 -178.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.488 HG21 ' HG2' ' A' ' 472' ' ' GLU . 4.7 mp -121.19 116.85 50.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 110.083 -0.34 . . . . 62.22 110.083 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.532 HG22 ' HB3' ' A' ' 501' ' ' TYR . 46.9 mt -97.49 120.56 46.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.399 -0.593 . . . . 75.41 109.399 175.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -69.06 -41.06 78.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.006 0.432 . . . . 75.15 110.483 -177.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . 0.683 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 34.2 mt-10 -137.47 107.95 6.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.94 -0.573 . . . . 73.42 110.407 -178.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -65.26 122.59 17.46 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.264 -0.643 . . . . 64.03 109.264 174.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' MET . . . . . 0.455 ' HG3' ' HG2' ' A' ' 520' ' ' GLU . 11.9 tpt -125.83 157.1 38.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.667 0.27 . . . . 75.43 110.858 -172.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.93 -38.14 84.76 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.231 -0.441 . . . . 74.41 111.397 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . 0.455 ' HG2' ' HG3' ' A' ' 518' ' ' MET . 10.4 pt-20 -70.15 -22.35 62.99 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.222 0.534 . . . . 75.3 110.832 178.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -88.09 -13.29 41.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.707 -0.679 . . . . 73.43 110.392 -176.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.475 ' HB1' ' HB ' ' A' ' 540' ' ' VAL . . . -63.0 6.19 0.11 Allowed 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.723 1.009 . . . . 74.24 113.723 -174.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -59.67 137.03 50.01 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.273 -0.731 . . . . 72.15 111.273 175.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -60.94 126.48 27.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.356 -0.238 . . . . 70.44 110.356 -175.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -84.95 131.15 34.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.83 0.824 . . . . 74.31 112.19 -174.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.1 135.79 48.62 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.765 -1.107 . . . . 65.13 109.837 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 9.9 tt -122.32 122.99 40.36 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.68 -0.489 . . . . 61.31 109.68 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . 0.505 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 57.6 m -103.61 124.55 49.02 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.983 -0.553 . . . . 75.52 110.598 -177.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.493 HG21 HG11 ' A' ' 477' ' ' VAL . 14.3 m -117.56 166.59 12.2 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.344 -0.613 . . . . 74.31 109.344 176.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 22.9 t -66.68 -11.24 53.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.82 0.343 . . . . 72.14 110.699 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -99.52 -83.6 1.74 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.0 -0.619 . . . . 71.44 112.05 177.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -114.02 166.96 12.2 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.7 -0.762 . . . . 63.23 112.24 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -109.92 122.71 48.18 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.802 -0.444 . . . . 64.5 109.802 177.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -103.2 135.12 45.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.46 -0.336 . . . . 74.25 110.431 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 8.3 tt -146.05 136.69 24.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.892 -0.41 . . . . 71.53 109.892 -178.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -143.5 155.27 44.29 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.278 -0.419 . . . . 72.44 109.945 178.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -96.54 112.06 23.95 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.4 0.619 . . . . 70.02 111.225 -177.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.847 HD13 ' HG3' ' A' ' 461' ' ' GLU . 62.8 tp -94.52 136.45 34.81 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.668 -0.697 . . . . 65.41 110.115 177.132 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.709 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 65.3 mt -133.15 134.03 57.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.848 -0.797 . . . . 75.01 108.848 175.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.475 ' HB ' ' HB1' ' A' ' 522' ' ' ALA . 98.4 t -122.84 116.28 48.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 110.021 -0.362 . . . . 71.03 110.021 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . 0.524 ' HG3' HD22 ' A' ' 464' ' ' LEU . 43.7 mt-30 -94.34 140.58 29.62 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.25 -0.432 . . . . 74.2 110.758 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . 0.447 ' HA ' ' CG1' ' A' ' 467' ' ' VAL . 41.9 tt0 -75.0 141.26 43.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.534 -0.757 . . . . 70.2 109.541 175.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . 0.427 ' HD3' ' SD ' ' A' ' 466' ' ' MET . 54.4 mtmt . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.13 -0.938 . . . . 75.04 109.512 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 112.416 -0.274 . . . . 53.32 112.416 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 31.3 m -73.17 129.5 38.19 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.856 0.36 . . . . 50.42 111.388 -177.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -108.95 178.54 4.44 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.068 -0.715 . . . . 73.43 109.068 172.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 57.2 mtm -113.94 99.07 49.6 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-O 120.903 0.382 . . . . 73.45 110.628 179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -72.23 135.76 25.45 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.073 1.849 . . . . 73.23 111.424 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' VAL . . . . . 0.427 HG13 ' HB ' ' A' ' 477' ' ' VAL . 19.6 t -74.9 111.26 10.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.59 -0.522 . . . . 72.02 109.59 178.064 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 90.6 mt -97.6 164.06 12.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.924 -0.58 . . . . 73.22 110.901 -175.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' ILE . . . . . 0.455 HD13 HG11 ' A' ' 477' ' ' VAL . 48.4 mm -96.87 115.06 35.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.838 -0.619 . . . . 63.45 110.193 -178.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 33.7 m -85.69 -35.61 20.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.145 0.498 . . . . 65.41 110.823 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' ARG . . . . . 0.804 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 5.7 mmp_? -108.52 108.14 60.71 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.094 -0.503 . . . . 71.14 110.362 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_exo -70.78 155.63 62.21 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.405 2.07 . . . . 72.2 111.436 176.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.11 162.7 23.59 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.774 -0.454 . . . . 74.2 109.774 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -69.91 121.04 16.56 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.487 0.661 . . . . 61.4 111.444 -173.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -92.22 -11.65 34.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.993 -1.003 . . . . 73.51 111.711 -176.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -87.56 156.01 19.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.127 0.489 . . . . 74.11 110.925 -170.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.66 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 6.0 tt -88.55 136.61 32.9 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.363 -0.835 . . . . 74.15 109.679 -171.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' VAL . . . . . 0.488 ' N ' HD22 ' A' ' 464' ' ' LEU . 30.6 m -120.97 172.25 8.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.269 0.557 . . . . 70.24 111.655 -173.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' MET . . . . . 0.575 ' H ' ' NE2' ' A' ' 469' ' ' GLN . 66.5 mtt -116.62 163.52 15.98 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.795 -0.639 . . . . 74.3 109.964 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 48.6 t -65.04 131.02 30.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.338 -0.392 . . . . 72.12 111.185 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.14 -14.32 58.43 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.818 -0.706 . . . . 74.51 114.602 171.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.575 ' NE2' ' H ' ' A' ' 466' ' ' MET . 9.6 pt20 -83.17 149.42 26.86 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.923 0.862 . . . . 71.11 110.637 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 44.8 ttt180 -73.6 116.1 13.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.524 -0.762 . . . . 71.21 110.567 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 95.0 t -120.86 123.38 70.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.792 -0.64 . . . . 75.53 109.859 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -133.92 140.79 47.02 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.185 0.517 . . . . 74.52 110.172 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.531 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 90.5 m-85 -105.99 124.8 50.15 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.854 -0.612 . . . . 73.51 110.786 -175.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -97.63 117.73 32.57 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.969 -1.123 . . . . 74.13 107.969 176.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' CYS . . . . . 0.804 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 6.4 p -140.23 119.04 12.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.184 0.516 . . . . 73.1 111.699 -175.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.599 ' HG2' ' CG ' ' A' ' 458' ' ' ARG . 10.1 pt-20 -131.05 148.81 52.79 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.005 -0.739 . . . . 74.35 109.005 175.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' VAL . . . . . 0.474 HG21 ' HB1' ' A' ' 482' ' ' ALA . 18.3 m -111.19 164.38 7.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 116.238 -0.437 . . . . 73.13 110.859 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 53.5 p -65.67 -25.89 67.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.032 -0.531 . . . . 75.42 112.403 -174.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -106.87 133.7 51.13 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.912 -0.315 . . . . 70.34 110.786 -174.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' GLU . . . . . 0.669 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 10.0 tp10 -73.36 147.4 44.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.086 -0.506 . . . . 74.43 110.673 -178.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 61.27 34.45 88.2 Favored Glycine 0 N--CA 1.453 -0.221 0 CA-C-N 115.898 -0.592 . . . . 74.25 112.82 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . 0.474 ' HB1' HG21 ' A' ' 477' ' ' VAL . . . -95.19 154.45 17.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.006 0.432 . . . . 73.5 111.062 -178.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -100.77 133.11 45.72 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.75 -0.659 . . . . 74.43 110.647 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . 0.494 ' HB ' HD22 ' A' ' 527' ' ' LEU . 32.5 m -124.15 144.24 34.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.931 -0.577 . . . . 72.32 109.547 175.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -126.96 141.04 51.9 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.751 0.31 . . . . 65.14 110.292 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -98.3 137.35 37.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.086 -0.507 . . . . 73.44 111.074 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 55.6 tp -134.21 118.78 18.0 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.747 -0.835 . . . . 75.54 108.747 173.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' LYS . . . . . 0.45 ' HD3' ' C ' ' A' ' 488' ' ' LYS . 14.1 tmtt? -109.52 106.2 15.83 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.703 -0.399 . . . . 72.3 110.518 -176.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 2.5 t70 48.66 38.74 12.08 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.333 -0.849 . . . . 73.23 112.015 173.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.62 -16.01 60.26 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.79 -0.719 . . . . 74.34 113.001 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 47.4 t -104.72 122.23 57.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.741 0.305 . . . . 72.11 110.427 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -81.46 133.94 35.47 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.765 -0.457 . . . . 65.13 109.765 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 69.4 mt -74.99 152.89 38.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.104 -0.498 . . . . 65.33 111.114 -175.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' THR . . . . . 0.62 HG23 ' H ' ' A' ' 496' ' ' GLU . 4.8 m -91.2 141.51 28.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.029 -0.532 . . . . 64.54 110.937 -175.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -83.13 -6.2 59.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.23 0.538 . . . . 74.23 110.539 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' GLU . . . . . 0.62 ' H ' HG23 ' A' ' 494' ' ' THR . 7.6 pt-20 -130.35 34.72 4.15 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.554 -0.748 . . . . 74.32 109.763 178.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' GLU . . . . . 0.56 ' HB2' ' HB ' ' A' ' 494' ' ' THR . 7.1 tp10 -71.93 170.71 13.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.315 -0.857 . . . . 71.42 110.782 -176.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' THR . . . . . 0.402 ' H ' ' HG3' ' A' ' 497' ' ' GLU . 8.9 t -68.58 -176.7 0.83 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.119 -0.491 . . . . 74.22 110.837 175.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -78.99 17.1 0.79 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.456 -0.338 . . . . 75.11 111.853 -174.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -61.87 -45.96 91.48 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.908 -0.775 . . . . 75.54 108.908 176.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' TYR . . . . . 0.529 ' HB3' HG12 ' A' ' 514' ' ' ILE . 10.1 p90 -143.04 143.39 31.86 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.054 -0.976 . . . . 73.24 109.52 176.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 35.9 p-90 -135.91 145.34 46.18 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.865 -0.42 . . . . 75.13 109.865 176.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' PHE . . . . . 0.466 ' HA ' ' O ' ' A' ' 511' ' ' HIS . 44.6 p90 -114.86 140.9 48.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.592 0.711 . . . . 71.45 111.818 -175.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' LYS . . . . . 0.45 ' HB3' ' HB2' ' A' ' 511' ' ' HIS . 24.1 tptm -116.31 114.18 23.99 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.802 -1.09 . . . . 75.13 109.137 176.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.487 ' O ' ' HD3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -112.37 138.37 49.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.06 0.457 . . . . 72.51 112.192 -176.169 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -149.59 85.41 1.44 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.836 -0.62 . . . . 64.32 109.855 170.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 69.5 -116.68 7.18 Favored Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 115.614 -0.721 . . . . 61.25 112.777 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' GLN . . . . . 0.669 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 4.1 pt20 -76.98 -25.95 53.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.708 0.29 . . . . 74.13 111.508 -177.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -99.12 127.0 44.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.374 0.606 . . . . 71.14 111.448 -174.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -129.39 155.96 44.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.477 -0.783 . . . . 70.44 109.705 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' HIS . . . . . 0.466 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 80.4 m-70 -138.9 124.58 19.62 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.897 -0.408 . . . . 73.23 109.897 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 56.9 tp -111.46 106.09 14.89 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.929 -0.397 . . . . 75.42 109.929 176.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' ILE . . . . . 0.401 ' N ' HD13 ' A' ' 513' ' ' ILE . 4.5 mp -103.25 118.41 50.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.06 0.457 . . . . 71.31 111.018 -176.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' ILE . . . . . 0.529 HG12 ' HB3' ' A' ' 501' ' ' TYR . 62.2 mt -101.9 121.76 53.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.145 -0.687 . . . . 74.25 109.145 174.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -64.14 -51.41 64.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.267 -0.424 . . . . 74.13 111.396 -174.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -133.01 114.87 14.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.342 -0.39 . . . . 73.2 110.151 175.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . 0.499 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -62.69 127.53 31.7 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.695 -0.483 . . . . 75.12 109.695 173.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 28.6 ttm -132.58 173.68 11.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.976 -0.379 . . . . 74.31 109.976 -174.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -53.43 -36.63 61.76 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.606 0.595 . . . . 74.01 112.606 -172.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' GLU . . . . . 0.413 ' H ' ' CD ' ' A' ' 520' ' ' GLU . 1.8 mp0 -58.92 -35.02 72.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.948 0.404 . . . . 74.14 110.895 -178.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' ASP . . . . . 0.422 ' C ' ' H ' ' A' ' 523' ' ' GLY . 32.8 m-20 -74.43 -13.52 60.72 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.995 -0.548 . . . . 73.43 112.223 -169.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' ALA . . . . . 0.555 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -63.78 7.33 0.12 Allowed 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.911 1.078 . . . . 72.33 113.911 -175.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' GLY . . . . . 0.422 ' H ' ' C ' ' A' ' 521' ' ' ASP . . . -86.63 169.3 40.82 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.987 -0.625 . . . . 72.14 112.443 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -73.97 119.84 18.74 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 122.717 -0.284 . . . . 74.51 110.804 -178.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -86.43 135.0 33.66 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.765 0.317 . . . . 72.2 110.804 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.4 134.63 47.28 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.062 0.458 . . . . 72.32 110.475 175.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 527' ' ' LEU . . . . . 0.494 HD22 ' HB ' ' A' ' 484' ' ' VAL . 7.5 tt -118.04 111.85 19.46 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.053 -0.721 . . . . 73.44 109.053 177.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 43.9 t -99.24 128.1 45.32 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.926 0.393 . . . . 72.41 110.593 -177.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 529' ' ' THR . . . . . 0.464 HG21 HG12 ' A' ' 477' ' ' VAL . 1.8 m -117.88 175.47 5.65 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.892 -0.594 . . . . 75.33 109.45 176.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 9.1 m -58.52 -24.36 60.38 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.014 0.375 . . . . 44.43 112.014 178.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -112.28 -88.38 1.76 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.637 -0.792 . . . . 73.35 112.21 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -94.18 -172.25 38.58 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.819 -0.705 . . . . 62.33 112.016 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -145.49 147.55 32.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.005 0.431 . . . . 74.02 110.725 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' ALA . . . . . 0.415 ' HB3' HG23 ' A' ' 456' ' ' ILE . . . -105.75 118.71 37.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.007 -0.542 . . . . 75.33 110.115 178.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 7.5 tt -114.99 124.72 52.4 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.441 -0.577 . . . . 74.5 109.441 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -148.36 149.11 31.2 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.985 -0.552 . . . . 74.2 109.809 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -116.77 112.92 21.83 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.372 0.606 . . . . 72.23 111.052 -177.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . 0.555 ' O ' ' HA ' ' A' ' 522' ' ' ALA . 31.3 tp -96.92 111.5 23.68 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.298 -0.864 . . . . 73.15 109.462 -179.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' ILE . . . . . 0.66 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 63.3 mt -97.47 129.11 48.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 110.129 -0.323 . . . . 73.12 110.129 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 34.7 t -111.54 116.47 52.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 61.42 110.601 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . 0.542 ' HG3' HD21 ' A' ' 464' ' ' LEU . 98.4 mt-30 -99.61 155.44 17.6 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.085 0.469 . . . . 75.34 111.173 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -80.56 149.75 29.82 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.615 -0.721 . . . . 74.22 110.654 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.723 -0.656 . . . . 73.42 110.157 -179.756 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo . . . . . 0 N--CA 1.458 -0.577 0 N-CA-C 111.537 -0.216 . . . . 43.439999999999998 111.537 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 48.2 t -66.34 115.83 4.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.623 -0.51 . . . . 72.430000000000007 109.623 176.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -78.59 143.57 36.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.172 -0.467 . . . . 34.119999999999997 110.884 -174.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.492 HG21 ' HB2' ' A' ' 534' ' ' ALA . 37.8 mm -95.49 110.77 24.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.356 -0.609 . . . . 63.299999999999997 109.356 175.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 457' ' ' THR . . . . . 0.437 ' HB ' ' HG3' ' A' ' 476' ' ' GLU . 16.5 m -67.99 -40.91 82.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.019 0.438 . . . . 74.129999999999995 111.318 -175.208 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.716 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 19.5 mmt85 -116.67 120.39 34.43 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.152 -0.476 . . . . 62.119999999999997 110.472 -176.448 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -76.12 165.53 29.48 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 121.935 1.757 . . . . 62.32 110.45 170.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 3.7 mm? -80.43 149.03 30.29 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.647 -0.421 . . . . 65.140000000000001 109.98 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 23.5 mp0 -52.62 119.38 4.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.267 -0.879 . . . . 63.439999999999998 111.999 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -92.01 -11.24 36.53 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.819 -1.082 . . . . 72.239999999999995 112.154 -176.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -88.69 155.12 19.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.166 0.508 . . . . 62.399999999999999 111.139 -172.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 9.4 tt -87.81 136.14 33.08 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.624 -0.716 . . . . 73.439999999999998 109.751 -174.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 35.7 m -121.44 175.65 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.987 -0.552 . . . . 75.340000000000003 110.937 -176.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 466' ' ' MET . . . . . 0.448 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 25.2 ptt? -120.85 152.25 38.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.199 -0.455 . . . . 72.329999999999998 111.077 -176.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 467' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 69.3 t -61.55 139.33 20.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.463 -0.79 . . . . 73.230000000000004 111.244 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.35 -18.34 54.01 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.76 -0.733 . . . . 61.229999999999997 114.105 173.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.448 ' HG2' ' O ' ' A' ' 466' ' ' MET . 9.7 pt20 -94.33 155.47 16.98 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 117.836 0.818 . . . . 75.120000000000005 110.953 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 470' ' ' ARG . . . . . 0.522 ' HG3' ' HA ' ' A' ' 515' ' ' ASN . 42.6 ttm180 -88.02 116.0 25.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.787 -0.642 . . . . 73.230000000000004 109.832 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.403 HG22 HE21 ' A' ' 469' ' ' GLN . 10.4 t -112.78 127.6 69.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.987 0.422 . . . . 65.519999999999996 110.877 -175.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -104.59 123.63 47.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.774 -0.648 . . . . 73.120000000000005 110.048 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.589 ' HE2' HD12 ' A' ' 514' ' ' ILE . 67.5 m-85 -107.39 134.34 50.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.209 -0.45 . . . . 72.430000000000007 109.941 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -122.96 118.43 27.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.03 0.443 . . . . 73.019999999999996 111.37 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 23.0 t -143.08 113.56 7.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.743 -0.662 . . . . 74.319999999999993 109.539 176.515 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.688 ' HB2' ' HA ' ' A' ' 509' ' ' ARG . 13.0 pt-20 -133.51 166.42 22.61 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.291 -0.413 . . . . 75.150000000000006 110.841 -177.01 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.545 HG21 ' HB3' ' A' ' 482' ' ' ALA . 6.7 m -101.09 159.56 3.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.757 -0.656 . . . . 72.099999999999994 110.505 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 22.2 t -80.79 -2.28 46.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.151 -0.477 . . . . 73.340000000000003 111.227 -176.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -134.17 132.8 40.23 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.691 -0.485 . . . . 63.109999999999999 109.691 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -78.94 153.02 30.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.179 0.514 . . . . 73.439999999999998 112.007 -173.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 95.62 -16.85 60.42 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.52 -0.763 . . . . 52.119999999999997 112.359 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.545 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -82.77 132.84 35.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.199 0.523 . . . . 72.430000000000007 111.521 -177.165 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -105.15 165.13 11.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.507 -0.769 . . . . 65.310000000000002 110.189 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.56 HG21 HD11 ' A' ' 527' ' ' LEU . 27.3 m -137.0 173.22 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.39 -0.368 . . . . 71.239999999999995 110.997 -174.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 485' ' ' LYS . . . . . 0.402 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 40.6 ttmt -117.44 140.32 49.74 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.08 -0.509 . . . . 60.130000000000003 109.649 174.145 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -98.71 124.05 43.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.152 0.501 . . . . 75.409999999999997 110.445 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 487' ' ' LEU . . . . . 0.406 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 53.2 tp -115.68 119.21 35.33 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.032 -0.729 . . . . 75.319999999999993 109.032 177.553 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.42 ' HE2' ' HA3' ' A' ' 523' ' ' GLY . 14.0 tmtt? -121.17 113.05 19.44 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.348 -0.387 . . . . 54.109999999999999 110.778 -175.518 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 489' ' ' ASP . . . . . 0.467 ' HB2' ' HA3' ' A' ' 523' ' ' GLY . 35.1 t0 55.22 37.92 29.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.483 -0.78 . . . . 70.409999999999997 111.43 173.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 85.03 -4.13 86.02 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.731 -0.747 . . . . 61.240000000000002 112.743 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 44.3 t -103.63 131.86 51.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 120.782 0.325 . . . . 71.329999999999998 110.387 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -83.29 113.96 21.06 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.669 -0.493 . . . . 74.239999999999995 109.669 177.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 92.9 mt -69.32 159.88 32.31 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 111.263 -176.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 494' ' ' THR . . . . . 0.669 HG23 ' HG2' ' A' ' 496' ' ' GLU . 7.5 t -89.54 155.14 19.47 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.771 -0.649 . . . . 75.120000000000005 110.175 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.5 ttt-85 -79.25 77.04 5.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.724 0.297 . . . . 63.530000000000001 110.547 -177.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 496' ' ' GLU . . . . . 0.669 ' HG2' HG23 ' A' ' 494' ' ' THR . 8.4 pt-20 -176.46 147.25 0.66 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.891 -0.595 . . . . 64.230000000000004 109.749 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 497' ' ' GLU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 502' ' ' TRP . 1.0 OUTLIER -104.52 171.32 7.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.966 0.412 . . . . 72.019999999999996 110.398 177.386 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.459 HG23 ' H ' ' A' ' 500' ' ' LYS . 7.8 t -149.04 -178.16 6.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.457 -0.572 . . . . 71.209999999999994 109.457 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -77.88 -3.84 43.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.793 0.33 . . . . 73.420000000000002 111.346 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 500' ' ' LYS . . . . . 0.459 ' H ' HG23 ' A' ' 498' ' ' THR . 64.2 tttp -82.8 -48.62 10.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.352 0.596 . . . . 64.099999999999994 109.535 174.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.615 ' HD2' HD11 ' A' ' 512' ' ' LEU . 19.7 p90 -151.71 141.66 22.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.364 -0.835 . . . . 75.209999999999994 109.371 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 502' ' ' TRP . . . . . 0.529 ' HZ3' ' HB2' ' A' ' 504' ' ' LYS . 55.0 p-90 -140.84 150.51 43.37 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.863 0.363 . . . . 72.519999999999996 110.602 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 503' ' ' PHE . . . . . 0.596 ' HA ' ' O ' ' A' ' 511' ' ' HIS . 41.1 p90 -124.76 139.67 53.64 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.14 -0.482 . . . . 70.230000000000004 110.147 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.529 ' HB2' ' HZ3' ' A' ' 502' ' ' TRP . 61.2 tttm -116.44 145.24 43.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.02 0.438 . . . . 63.509999999999998 110.688 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -107.0 141.78 37.66 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.52 -0.764 . . . . 72.25 109.911 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 506' ' ' ASP . . . . . 0.519 ' HB3' ' CG ' ' A' ' 509' ' ' ARG . 38.6 t70 -149.94 87.14 1.46 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.863 -0.421 . . . . 63.329999999999998 109.863 170.41 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.45 -87.96 0.2 Allowed Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.769 -0.65 . . . . 73.040000000000006 112.675 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -107.52 -27.23 10.52 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.09 0.471 . . . . 74.209999999999994 110.924 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.688 ' HA ' ' HB2' ' A' ' 476' ' ' GLU . 6.7 ptp180 -87.99 143.2 27.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.356 0.598 . . . . 72.510000000000005 111.684 -170.326 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -135.12 126.9 29.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.354 -0.839 . . . . 73.430000000000007 109.108 179.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 511' ' ' HIS . . . . . 0.596 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 25.8 m-70 -121.2 126.79 50.53 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.949 -0.389 . . . . 74.430000000000007 109.949 -177.281 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.615 HD11 ' HD2' ' A' ' 501' ' ' TYR . 62.8 tp -110.66 108.06 17.84 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.806 -0.442 . . . . 63.43 109.806 178.001 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.413 HD12 ' N ' ' A' ' 513' ' ' ILE . 3.7 mp -105.14 123.83 59.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 120.852 0.358 . . . . 74.409999999999997 110.648 -176.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.589 HD12 ' HE2' ' A' ' 473' ' ' PHE . 45.1 mt -105.53 122.15 58.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 64.310000000000002 109.522 175.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 515' ' ' ASN . . . . . 0.522 ' HA ' ' HG3' ' A' ' 470' ' ' ARG . 43.1 m-80 -66.13 -42.01 89.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.922 -0.581 . . . . 74.109999999999999 111.976 -172.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -140.94 116.02 9.86 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.352 -0.24 . . . . 74.540000000000006 110.352 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.417 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -62.6 123.46 18.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.924 -0.398 . . . . 63.119999999999997 109.924 175.557 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 45.0 tpp -132.65 171.94 13.19 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.697 -0.483 . . . . 75.420000000000002 109.697 -177.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -56.46 -32.28 64.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.571 0.224 . . . . 73.540000000000006 111.004 177.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -59.25 -37.25 77.11 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.402 0.62 . . . . 72.25 110.525 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -86.73 -13.22 45.96 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.119 -0.946 . . . . 44.140000000000001 110.894 -173.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.464 ' HB2' ' HB ' ' A' ' 540' ' ' VAL . . . -66.91 7.62 0.36 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.222 0.823 . . . . 53.240000000000002 113.222 -176.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 523' ' ' GLY . . . . . 0.467 ' HA3' ' HB2' ' A' ' 489' ' ' ASP . . . -79.23 165.96 50.99 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.701 -0.761 . . . . 73.040000000000006 112.309 178.208 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 57.1 m170 -71.07 151.39 44.57 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 122.76 -0.259 . . . . 71.040000000000006 110.625 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -124.83 124.86 42.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.19 0.519 . . . . 75.209999999999994 111.496 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.406 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -128.77 135.44 49.18 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.919 -0.582 . . . . 42.5 110.348 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.613 HD13 ' SG ' ' A' ' 475' ' ' CYS . 2.1 tt -107.95 107.83 18.71 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.999 -0.546 . . . . 73.120000000000005 109.909 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 528' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 70.2 m -88.8 114.85 25.86 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.073 -0.512 . . . . 74.510000000000005 111.676 -174.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.545 ' HB ' ' O ' ' A' ' 532' ' ' GLY . 9.3 m -119.19 158.16 26.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.681 -0.691 . . . . 73.25 109.669 173.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 12.5 m -68.26 -26.65 65.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.804 0.335 . . . . 74.219999999999999 111.387 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -87.89 -90.76 1.07 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.824 -0.703 . . . . 70.319999999999993 111.637 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 532' ' ' GLY . . . . . 0.545 ' O ' ' HB ' ' A' ' 529' ' ' THR . . . -97.34 176.05 31.15 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.639 -0.791 . . . . 63.140000000000001 111.272 174.468 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -141.07 126.95 19.23 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.874 -0.417 . . . . 64.200000000000003 109.874 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 534' ' ' ALA . . . . . 0.492 ' HB2' HG21 ' A' ' 456' ' ' ILE . . . -96.93 117.75 31.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.387 -0.369 . . . . 73.420000000000002 110.112 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.418 HD23 ' N ' ' A' ' 536' ' ' ALA . 5.4 tt -120.79 127.82 52.31 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.331 -0.618 . . . . 63.039999999999999 109.331 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.555 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -148.55 153.88 39.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.267 -0.424 . . . . 73.549999999999997 110.157 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -119.18 118.86 32.46 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.373 0.606 . . . . 70.129999999999995 110.775 -176.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 44.3 tp -96.86 136.71 37.03 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.942 -1.026 . . . . 75.340000000000003 110.125 -177.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.422 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 65.6 mt -116.77 113.36 42.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.148 -0.478 . . . . 73.099999999999994 109.783 175.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.464 ' HB ' ' HB2' ' A' ' 522' ' ' ALA . 44.1 t -101.74 105.48 18.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.886 -0.597 . . . . 73.319999999999993 109.695 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -88.49 151.15 22.73 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.241 0.543 . . . . 72.129999999999995 111.267 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -76.82 162.76 27.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.261 -0.881 . . . . 73.040000000000006 112.214 -169.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 543' ' ' LYS . . . . . 0.401 ' HB3' ' NZ ' ' A' ' 543' ' ' LYS . 8.2 mtpm? . . . . . 0 C--O 1.251 1.159 0 CA-C-N 115.087 -0.96 . . . . 63.210000000000001 109.174 173.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo . . . . . 0 N--CA 1.462 -0.37 0 N-CA-C 111.447 -0.251 . . . . 73.140000000000001 111.447 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.45 HG21 ' HB3' ' A' ' 530' ' ' SER . 48.3 t -67.12 110.21 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.809 0.338 . . . . 65.239999999999995 110.597 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 86.6 mt -78.83 130.47 35.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.968 -0.56 . . . . 73.549999999999997 110.524 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 45.7 mm -91.28 110.44 22.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.866 -0.606 . . . . 64.329999999999998 110.057 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 26.3 m -79.95 -28.87 39.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.29 -0.414 . . . . 75.049999999999997 111.346 -176.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.535 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 36.3 mmt-85 -126.35 119.02 23.26 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.61 -0.268 . . . . 63.299999999999997 111.077 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 459' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 458' ' ' ARG . 3.0 Cg_exo -76.06 167.27 26.36 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 123.062 2.508 . . . . 55.109999999999999 111.548 174.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 91.2 mt -81.94 169.58 16.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.646 0.26 . . . . 75.409999999999997 110.609 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -69.57 120.05 14.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.029 -0.532 . . . . 63.100000000000001 111.426 -175.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -93.61 -14.36 26.58 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.861 -0.608 . . . . 65.129999999999995 111.32 178.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.9 pm0 -90.73 157.42 17.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.335 0.588 . . . . 75.349999999999994 111.623 -173.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 10.5 tt -87.48 142.15 28.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.185 -0.916 . . . . 72.140000000000001 110.713 -170.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.487 HG23 HG22 ' A' ' 540' ' ' VAL . 28.9 m -126.75 174.0 11.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.996 -0.547 . . . . 64.109999999999999 110.269 -179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 466' ' ' MET . . . . . 0.509 ' HG2' ' HG3' ' A' ' 541' ' ' GLN . 46.7 mtm -133.13 162.24 32.26 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.418 -0.355 . . . . 74.450000000000003 110.882 -178.153 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 467' ' ' VAL . . . . . 0.541 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 49.8 t -64.63 137.36 25.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.911 -0.586 . . . . 61.140000000000001 111.618 -176.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 100.93 -0.68 55.09 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.764 -0.731 . . . . 71.400000000000006 114.039 173.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -120.08 159.0 25.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.42 0.61 . . . . 63.240000000000002 110.715 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 470' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 514' ' ' ILE . 37.6 ttm105 -87.38 138.59 31.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 63.140000000000001 111.176 -175.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 47.1 t -115.96 133.34 62.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.92 -0.582 . . . . 62.32 110.454 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -109.21 122.81 48.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.203 -0.453 . . . . 71.140000000000001 110.036 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.653 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 64.9 m-85 -108.31 112.29 24.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.385 -0.371 . . . . 64.030000000000001 110.418 176.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.513 ' HG2' ' CE1' ' A' ' 511' ' ' HIS . 33.7 mt-10 -98.71 120.11 38.59 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.284 -0.636 . . . . 64.200000000000003 109.284 174.005 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.535 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 13.9 t -144.84 109.16 4.84 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.089 -0.708 . . . . 73.340000000000003 109.089 171.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.514 ' OE1' ' HB2' ' A' ' 509' ' ' ARG . 0.4 OUTLIER -113.93 134.63 54.7 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.699 -0.852 . . . . 74.109999999999999 108.699 -176.277 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.532 HG21 ' HB3' ' A' ' 482' ' ' ALA . 30.0 m -95.61 145.23 8.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.567 -0.531 . . . . 60.439999999999998 109.567 176.468 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 32.3 t -72.64 -11.73 60.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.328 -0.396 . . . . 61.310000000000002 111.721 -175.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -133.12 137.62 46.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.846 0.355 . . . . 65.040000000000006 111.886 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -71.01 149.3 46.77 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.855 -0.611 . . . . 75.310000000000002 109.663 174.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 84.42 15.43 68.83 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.663 -0.78 . . . . 72.549999999999997 112.34 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.532 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -91.73 110.47 21.81 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.799 0.333 . . . . 72.049999999999997 110.733 177.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.53 143.89 55.91 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.948 -0.569 . . . . 63.140000000000001 110.515 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 22.3 m -128.62 143.41 41.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.215 -0.448 . . . . 73.540000000000006 110.497 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 485' ' ' LYS . . . . . 0.48 ' HB3' ' HB3' ' A' ' 528' ' ' CYS . 25.1 ttmm -129.09 129.25 44.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.056 -0.52 . . . . 65.120000000000005 110.155 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -98.46 119.77 37.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.124 0.488 . . . . 75.510000000000005 110.762 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 7.8 tt -116.99 119.74 36.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.734 -0.666 . . . . 74.230000000000004 109.331 178.38 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -105.05 105.73 15.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.418 -0.356 . . . . 74.310000000000002 110.815 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 489' ' ' ASP . . . . . 0.454 ' HB2' ' HA3' ' A' ' 523' ' ' GLY . 4.0 t70 46.88 46.33 15.44 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.257 -0.883 . . . . 65.329999999999998 111.33 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.36 -27.25 20.29 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.743 -0.662 . . . . 72.109999999999999 113.22 177.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 47.5 t -101.5 119.22 49.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 117.12 0.46 . . . . 63.439999999999998 110.775 -176.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -65.32 128.73 37.06 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.725 -0.472 . . . . 71.040000000000006 109.725 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 4.4 pp -91.52 163.13 14.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.758 0.313 . . . . 71.439999999999998 110.301 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 2.4 p -100.05 142.66 31.23 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.086 0.47 . . . . 72.109999999999999 111.583 -176.292 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.41 2.29 9.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.652 -0.703 . . . . 73.230000000000004 111.427 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -126.77 34.68 4.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.156 -0.475 . . . . 62.030000000000001 110.767 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -82.98 -179.94 7.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.892 -0.594 . . . . 61.310000000000002 111.396 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 13.7 t -65.11 165.71 10.77 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.824 -0.626 . . . . 72.239999999999995 111.635 -176.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -74.93 14.26 0.54 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.626 -0.715 . . . . 63.439999999999998 112.603 -173.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -59.15 -44.93 92.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.214 0.53 . . . . 72.420000000000002 110.218 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.428 ' CB ' HG12 ' A' ' 514' ' ' ILE . 1.5 p90 -144.62 125.04 13.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.516 -0.766 . . . . 74.099999999999994 109.681 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -123.26 160.24 27.04 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.831 -0.622 . . . . 70.340000000000003 110.162 -174.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -124.02 151.08 44.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.14 0.495 . . . . 65.099999999999994 111.357 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -117.16 138.27 51.78 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.524 -0.762 . . . . 52.25 109.939 175.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.57 ' NZ ' ' HB3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -113.77 105.1 12.88 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.66 -0.867 . . . . 75.040000000000006 108.66 175.806 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 506' ' ' ASP . . . . . 0.638 ' HB2' ' HG2' ' A' ' 509' ' ' ARG . 32.4 m-20 -115.39 88.36 2.86 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.565 -0.531 . . . . 72.209999999999994 109.565 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 64.15 -94.8 0.16 Allowed Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.873 -0.603 . . . . 52.329999999999998 112.584 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.501 ' O ' HG22 ' A' ' 477' ' ' VAL . 20.2 pt20 -103.31 -20.69 14.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.898 0.38 . . . . 75.150000000000006 111.108 -177.364 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.638 ' HG2' ' HB2' ' A' ' 506' ' ' ASP . 28.6 ptt180 -92.28 148.87 21.8 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.441 -0.504 . . . . 74.530000000000001 111.075 -172.483 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -134.47 117.13 15.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.783 -0.644 . . . . 71.129999999999995 109.906 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 511' ' ' HIS . . . . . 0.513 ' CE1' ' HG2' ' A' ' 474' ' ' GLU . 23.1 m-70 -121.22 126.79 50.49 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.806 -0.358 . . . . 71.140000000000001 111.098 -177.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.4 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 58.3 tp -107.33 117.36 33.86 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.107 -0.701 . . . . 72.510000000000005 109.107 176.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 68.6 mt -111.51 108.33 25.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 120.961 0.41 . . . . 71.450000000000003 110.871 -175.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.504 ' O ' ' HG3' ' A' ' 470' ' ' ARG . 35.8 mt -86.86 120.55 36.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.543 -0.91 . . . . 75.230000000000004 108.543 173.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -68.61 -45.88 70.77 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.899 -0.32 . . . . 54.409999999999997 110.715 -176.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -140.61 109.12 5.89 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.641 -0.503 . . . . 72.239999999999995 109.641 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.541 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -64.62 136.43 56.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.954 -0.566 . . . . 72.120000000000005 111.013 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 72.1 mtm -134.16 174.91 9.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.96 -0.563 . . . . 75.430000000000007 110.521 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.463 HD22 ' H ' ' A' ' 519' ' ' LEU . 3.1 mm? -53.53 -33.0 52.96 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.769 0.655 . . . . 64.230000000000004 112.769 -171.361 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.71 -29.7 68.3 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.412 0.625 . . . . 74.25 111.297 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 521' ' ' ASP . . . . . 0.482 ' HB2' HG21 ' A' ' 540' ' ' VAL . 30.3 m-20 -82.14 -11.86 58.5 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.326 -0.852 . . . . 74.299999999999997 111.462 -170.598 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.497 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -67.22 6.61 0.53 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.394 0.516 . . . . 74.209999999999994 112.394 178.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 523' ' ' GLY . . . . . 0.454 ' HA3' ' HB2' ' A' ' 489' ' ' ASP . . . -80.99 167.99 50.37 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 121.051 -0.595 . . . . 54.340000000000003 112.359 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 524' ' ' HIS . . . . . 0.423 ' CD2' ' HB3' ' A' ' 537' ' ' GLU . 62.8 m80 -79.86 106.58 11.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.688 0.28 . . . . 73.430000000000007 110.935 -178.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -76.57 124.36 27.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.383 0.611 . . . . 74.439999999999998 111.035 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -123.75 135.95 54.14 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.464 -0.789 . . . . 50.149999999999999 109.585 175.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.623 ' HB3' ' HB3' ' A' ' 534' ' ' ALA . 6.2 tt -117.2 108.64 15.91 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.425 -0.583 . . . . 71.230000000000004 109.425 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 528' ' ' CYS . . . . . 0.48 ' HB3' ' HB3' ' A' ' 485' ' ' LYS . 42.3 t -86.76 115.29 24.1 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.051 -0.722 . . . . 65.129999999999995 109.051 176.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.436 HG22 ' H ' ' A' ' 530' ' ' SER . 0.2 OUTLIER -95.3 175.18 6.69 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.501 -0.318 . . . . 64.150000000000006 110.417 -176.908 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 530' ' ' SER . . . . . 0.45 ' HB3' HG21 ' A' ' 454' ' ' VAL . 22.9 t -65.3 -5.99 8.69 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.922 0.391 . . . . 71.099999999999994 111.313 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -149.5 -54.81 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.711 -0.757 . . . . 60.310000000000002 112.469 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -95.47 -171.49 36.31 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.803 -0.713 . . . . 41.43 112.837 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.1 pt20 -140.98 136.93 32.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.876 0.37 . . . . 70.239999999999995 110.407 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 534' ' ' ALA . . . . . 0.623 ' HB3' ' HB3' ' A' ' 527' ' ' LEU . . . -115.98 143.52 45.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.119 -0.491 . . . . 61.509999999999998 109.954 176.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 64.3 tp -147.29 126.19 12.75 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.62 -0.264 . . . . 75.209999999999994 110.445 -178.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -150.1 152.01 34.09 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.259 -0.428 . . . . 53.539999999999999 110.208 177.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 537' ' ' GLU . . . . . 0.423 ' HB3' ' CD2' ' A' ' 524' ' ' HIS . 10.4 pt-20 -108.38 113.98 27.48 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.148 0.499 . . . . 73.109999999999999 110.41 178.256 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.653 HD22 ' HZ ' ' A' ' 473' ' ' PHE . 39.4 tp -96.3 111.43 23.5 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.928 -0.767 . . . . 62.329999999999998 108.928 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 48.4 mt -93.06 112.74 26.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 116.409 -0.36 . . . . 63.240000000000002 110.342 -177.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.487 HG22 HG23 ' A' ' 465' ' ' VAL . 24.6 t -109.4 113.14 43.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.831 -0.622 . . . . 71.140000000000001 109.787 177.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 541' ' ' GLN . . . . . 0.509 ' HG3' ' HG2' ' A' ' 466' ' ' MET . 12.0 pt20 -115.18 157.24 23.93 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.023 0.439 . . . . 72.019999999999996 110.978 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -78.69 135.23 37.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.541 -0.754 . . . . 74.230000000000004 110.282 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 543' ' ' LYS . . . . . 0.444 ' HE2' ' O ' ' A' ' 467' ' ' VAL . 59.0 pttt . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.735 -0.65 . . . . 72.129999999999995 109.901 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo . . . . . 0 N--CA 1.458 -0.603 0 N-CA-C 111.405 -0.267 . . . . 74.25 111.405 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 56.9 t -66.92 112.48 2.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 109.926 -0.398 . . . . 60.210000000000001 109.926 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 89.6 mt -90.06 144.09 26.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.521 . . . . 65.400000000000006 111.458 -175.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.493 HD13 HG12 ' A' ' 477' ' ' VAL . 42.9 mm -104.73 113.6 42.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.649 -0.705 . . . . 75.549999999999997 109.876 178.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 457' ' ' THR . . . . . 0.413 ' OG1' ' HG3' ' A' ' 476' ' ' GLU . 2.9 p -93.8 -4.84 49.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.843 0.354 . . . . 63.439999999999998 111.873 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.618 ' HB2' ' HG2' ' A' ' 476' ' ' GLU . 0.0 OUTLIER -135.02 99.68 12.25 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.562 -0.29 . . . . 74.439999999999998 110.544 177.946 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -71.64 167.15 27.27 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.651 2.234 . . . . 72.299999999999997 111.973 174.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.588 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 79.0 mt -83.66 171.05 13.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.275 -0.42 . . . . 72.030000000000001 111.407 -175.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 461' ' ' GLU . . . . . 0.441 ' HB2' ' HE1' ' A' ' 473' ' ' PHE . 7.8 mm-40 -67.7 118.38 10.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.921 -0.581 . . . . 63.210000000000001 111.089 -179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -95.37 -11.24 28.06 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.908 -0.587 . . . . 74.319999999999993 111.838 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -88.65 157.5 18.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.293 0.568 . . . . 73.430000000000007 111.794 -170.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 8.8 tt -87.24 131.88 34.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.394 -0.821 . . . . 74.209999999999994 110.228 -172.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 33.1 m -124.92 176.24 6.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.871 -0.604 . . . . 71.209999999999994 110.659 -177.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -113.69 157.51 22.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.046 0.451 . . . . 60.43 110.926 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 73.3 t -66.49 138.67 22.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.549 -0.751 . . . . 74.340000000000003 111.272 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.01 -2.06 55.25 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.913 -0.661 . . . . 71.25 114.004 174.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -110.28 163.08 13.99 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 117.671 0.736 . . . . 75.25 111.068 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -82.28 131.03 35.23 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.725 -0.671 . . . . 72.340000000000003 110.863 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 60.7 t -131.61 122.0 49.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.243 -0.435 . . . . 74.200000000000003 110.169 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.62 ' HG2' HG12 ' A' ' 513' ' ' ILE . 21.8 mt-10 -101.68 138.58 38.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.079 0.466 . . . . 64.340000000000003 111.222 176.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.647 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 35.3 m-85 -105.69 112.98 26.27 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.943 -0.762 . . . . 71.230000000000004 108.943 171.104 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.421 ' HB2' ' HE ' ' A' ' 458' ' ' ARG . 42.8 mt-10 -98.29 117.63 33.12 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.467 -0.568 . . . . 63.009999999999998 109.467 179.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.504 ' HA ' ' HB3' ' A' ' 458' ' ' ARG . 22.5 t -132.72 125.28 29.87 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.793 -0.447 . . . . 74.439999999999998 109.793 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.618 ' HG2' ' HB2' ' A' ' 458' ' ' ARG . 11.3 pt-20 -133.08 153.76 51.21 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.958 -0.564 . . . . 73.219999999999999 109.996 178.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.559 HG21 ' HB3' ' A' ' 482' ' ' ALA . 8.1 m -117.37 155.49 19.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 115.465 -0.789 . . . . 64.430000000000007 109.906 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 6.5 p -81.16 -2.44 48.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.056 0.455 . . . . 75.230000000000004 111.638 -177.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -124.4 130.47 52.54 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.604 -0.887 . . . . 71.439999999999998 108.604 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -89.13 132.76 34.67 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.226 0.536 . . . . 45.32 111.605 -174.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 102.73 6.42 46.58 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.81 -0.71 . . . . 24.120000000000001 111.975 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.559 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -82.13 127.53 33.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.694 0.283 . . . . 55.299999999999997 110.481 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -80.09 142.85 34.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.117 -0.492 . . . . 73.329999999999998 110.671 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.54 HG12 HG22 ' A' ' 529' ' ' THR . 35.7 m -124.04 148.77 28.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.965 -0.561 . . . . 71.310000000000002 110.579 -177.725 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 485' ' ' LYS . . . . . 0.41 ' HE3' ' HA ' ' A' ' 485' ' ' LYS . 1.3 tpmt? -127.29 134.84 49.98 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.25 -0.432 . . . . 74.230000000000004 110.238 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -97.85 120.83 38.94 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.941 -0.392 . . . . 74.420000000000002 109.941 177.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 51.0 tp -116.82 120.61 39.05 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.651 -0.5 . . . . 55.25 109.651 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.442 ' HD3' ' C ' ' A' ' 488' ' ' LYS . 14.2 tmtt? -109.3 106.89 16.9 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.862 0.363 . . . . 74.340000000000003 110.599 -176.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.6 t70 51.02 37.86 18.95 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.534 -0.757 . . . . 65.129999999999995 111.871 174.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 91.92 -14.04 65.33 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.769 -0.729 . . . . 52.530000000000001 112.641 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 40.0 t -94.33 130.0 43.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.783 0.325 . . . . 73.120000000000005 110.171 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -89.96 114.66 26.52 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.546 -0.909 . . . . 74.519999999999996 108.546 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.519 ' O ' HD12 ' A' ' 493' ' ' LEU . 2.2 pp -74.0 134.35 43.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.703 0.763 . . . . 75.430000000000007 112.125 -172.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.93 174.53 11.52 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.079 -0.964 . . . . 64.530000000000001 111.265 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 495' ' ' ARG . . . . . 0.462 ' HD3' ' N ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -115.81 22.58 12.95 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.865 0.32 . . . . 73.340000000000003 111.865 -167.81 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 19.9 pm0 -126.74 20.25 7.15 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.661 0.245 . . . . 74.329999999999998 111.661 -177.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -82.87 159.94 22.26 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.579 0.228 . . . . 75.340000000000003 110.627 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.442 HG23 ' H ' ' A' ' 500' ' ' LYS . 14.2 t -75.83 -179.67 4.95 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.149 0.499 . . . . 71.150000000000006 111.463 -176.41 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -81.28 19.64 0.93 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.672 0.619 . . . . 55.530000000000001 112.672 -172.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 500' ' ' LYS . . . . . 0.523 ' O ' ' HB3' ' A' ' 515' ' ' ASN . 58.7 tttp -63.17 -21.52 66.26 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.832 -0.803 . . . . 72.109999999999999 108.832 173.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.503 ' HB2' ' HA ' ' A' ' 514' ' ' ILE . 21.1 p90 -155.16 147.42 23.83 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 108.015 -1.105 . . . . 71.510000000000005 108.015 167.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 8.5 p-90 -154.09 159.12 41.36 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.212 -0.292 . . . . 74.239999999999995 110.212 -175.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -111.31 161.24 16.25 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.699 -0.4 . . . . 74.120000000000005 111.309 -177.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.978 ' HG2' ' HB2' ' A' ' 511' ' ' HIS . 14.4 ptpt -129.73 149.54 51.43 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 109.028 -0.73 . . . . 70.439999999999998 109.028 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.45 121.37 44.09 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.853 0.359 . . . . 73.219999999999999 110.509 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -115.97 80.96 1.52 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.568 -0.53 . . . . 62.310000000000002 109.568 175.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.65 -110.33 3.39 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.796 -0.716 . . . . 52.140000000000001 112.293 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -95.28 -5.54 43.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.347 0.594 . . . . 74.329999999999998 110.191 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.57 ' HG2' ' CB ' ' A' ' 476' ' ' GLU . 68.4 mtt85 -100.17 134.15 43.53 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.592 -0.731 . . . . 74.319999999999993 110.546 -175.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -116.51 134.38 54.92 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.825 0.345 . . . . 73.530000000000001 110.511 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 511' ' ' HIS . . . . . 0.978 ' HB2' ' HG2' ' A' ' 504' ' ' LYS . 11.5 m170 -117.91 123.2 45.25 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.15 -0.477 . . . . 74.120000000000005 110.111 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.467 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 46.7 tp -98.26 105.6 17.77 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.452 -0.573 . . . . 61.119999999999997 109.452 172.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.726 HD11 ' HE2' ' A' ' 504' ' ' LYS . 16.4 mt -93.67 107.6 19.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.937 -0.574 . . . . 73.519999999999996 110.451 -176.415 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.503 ' HA ' ' HB2' ' A' ' 501' ' ' TYR . 45.4 mt -78.13 114.89 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 106.615 -1.624 . . . . 73.25 106.615 168.137 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 515' ' ' ASN . . . . . 0.523 ' HB3' ' O ' ' A' ' 500' ' ' LYS . 9.3 t30 -72.51 -42.04 65.24 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.356 0.598 . . . . 65.120000000000005 109.838 -176.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -130.95 104.1 6.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.294 -0.866 . . . . 65.310000000000002 109.919 174.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -55.64 133.87 50.83 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.218 -0.66 . . . . 63.219999999999999 109.218 173.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 518' ' ' MET . . . . . 0.524 ' H ' ' HB3' ' A' ' 521' ' ' ASP . 6.9 tpt -134.18 171.53 14.11 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.814 0.34 . . . . 63.0 111.389 -169.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.778 HD11 ' HB2' ' A' ' 542' ' ' GLU . 3.8 mm? -64.75 -49.27 71.43 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.306 -0.406 . . . . 75.040000000000006 111.699 -178.221 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -67.77 -22.41 65.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.141 0.496 . . . . 63.109999999999999 109.88 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 521' ' ' ASP . . . . . 0.524 ' HB3' ' H ' ' A' ' 518' ' ' MET . 16.6 t70 -74.74 -16.5 60.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.246 -0.888 . . . . 73.420000000000002 111.115 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.448 ' HB2' ' HB ' ' A' ' 540' ' ' VAL . . . -67.96 7.94 0.47 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.788 0.662 . . . . 44.549999999999997 112.788 -178.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -73.77 169.42 53.57 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 121.079 -0.581 . . . . 55.210000000000001 112.111 178.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 65.1 m170 -72.49 147.07 46.39 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.487 -0.42 . . . . 72.530000000000001 110.16 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -119.78 135.53 54.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.143 0.497 . . . . 74.219999999999999 111.431 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.45 ' HB2' ' HG ' ' A' ' 535' ' ' LEU . . . -144.06 135.46 25.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.839 -0.619 . . . . 34.340000000000003 110.637 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 10.5 tt -113.25 129.37 56.54 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.111 -0.7 . . . . 73.200000000000003 109.111 175.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 28.1 t -117.71 137.15 52.88 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.835 0.35 . . . . 74.099999999999994 110.27 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.54 HG22 HG12 ' A' ' 484' ' ' VAL . 67.5 p -109.55 -174.2 2.44 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.026 -0.534 . . . . 74.319999999999993 109.885 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 3.6 m -66.6 -11.17 52.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.167 -0.47 . . . . 65.409999999999997 110.651 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -115.8 -90.47 1.64 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 121.149 -0.548 . . . . 52.130000000000003 112.293 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -104.32 -173.06 25.08 Favored Glycine 0 C--O 1.236 0.221 0 C-N-CA 120.675 -0.774 . . . . 52.299999999999997 112.613 -178.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -133.83 156.74 47.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.895 0.379 . . . . 74.019999999999996 110.802 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -125.62 117.79 24.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.847 -0.615 . . . . 72.129999999999995 109.867 175.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.45 ' HG ' ' HB2' ' A' ' 526' ' ' ALA . 7.2 tt -118.37 132.85 56.25 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.347 -0.388 . . . . 75.219999999999999 110.414 -176.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.588 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -148.79 142.06 25.11 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.831 -0.622 . . . . 75.510000000000005 109.652 176.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -97.74 119.44 36.33 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.405 0.621 . . . . 71.0 111.042 -177.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.647 HD22 ' HZ ' ' A' ' 473' ' ' PHE . 43.8 tp -96.49 112.51 24.23 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.668 -0.697 . . . . 75.430000000000007 109.319 177.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 52.9 mt -93.64 112.16 26.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.694 -0.484 . . . . 63.109999999999999 109.694 178.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.448 ' HB ' ' HB2' ' A' ' 522' ' ' ALA . 23.4 t -106.16 110.97 33.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.111 -0.495 . . . . 73.099999999999994 110.138 -179.178 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -94.11 138.4 32.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.09 -0.505 . . . . 74.510000000000005 110.789 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 542' ' ' GLU . . . . . 0.779 ' HG2' ' HD3' ' A' ' 543' ' ' LYS . 21.3 tt0 -79.18 159.46 27.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.3 -0.409 . . . . 71.230000000000004 109.919 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 543' ' ' LYS . . . . . 0.779 ' HD3' ' HG2' ' A' ' 542' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.473 -0.775 . . . . 51.509999999999998 110.498 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo . . . . . 0 N--CA 1.464 -0.261 0 CA-C-O 120.695 0.206 . . . . 71.209999999999994 111.737 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.435 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 30.6 t -65.94 123.75 19.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.419 -0.355 . . . . 54.409999999999997 110.275 -177.466 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 6.6 mp -78.55 140.22 38.54 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.953 -0.567 . . . . 50.130000000000003 110.859 -177.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.588 HG13 ' HB2' ' A' ' 534' ' ' ALA . 33.7 mm -91.86 112.04 25.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.577 -0.738 . . . . 62.119999999999997 109.432 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 457' ' ' THR . . . . . 0.421 ' OG1' ' HG3' ' A' ' 476' ' ' GLU . 0.4 OUTLIER -85.29 -25.62 27.1 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.095 0.405 . . . . 64.430000000000007 112.095 -177.041 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.502 ' HB2' ' HG2' ' A' ' 476' ' ' GLU . 6.4 mmm180 -130.61 111.66 16.32 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 110.096 -0.335 . . . . 72.450000000000003 110.096 177.184 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.15 168.5 23.9 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.966 2.444 . . . . 75.129999999999995 112.019 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.499 HD21 ' HB2' ' A' ' 527' ' ' LEU . 3.5 mm? -80.22 160.08 25.72 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.924 -0.398 . . . . 51.030000000000001 109.924 -178.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 461' ' ' GLU . . . . . 0.591 ' HG2' ' HD1' ' A' ' 473' ' ' PHE . 27.1 mm-40 -58.55 119.02 6.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.904 -0.589 . . . . 73.030000000000001 111.071 -176.04 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -93.15 -10.94 34.08 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.675 -0.693 . . . . 72.140000000000001 111.616 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 463' ' ' GLN . . . . . 0.575 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 6.0 pm0 -88.53 156.51 19.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.117 0.484 . . . . 73.120000000000005 111.254 -174.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 10.5 tt -87.07 138.39 31.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.661 -0.7 . . . . 61.200000000000003 110.981 -168.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.559 HG22 HD11 ' A' ' 538' ' ' LEU . 29.7 m -125.98 177.6 5.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.74 -0.664 . . . . 72.120000000000005 110.809 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 466' ' ' MET . . . . . 0.49 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 38.1 mtm -133.62 156.1 48.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.758 0.314 . . . . 74.310000000000002 111.202 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 467' ' ' VAL . . . . . 0.491 ' CG2' ' HA ' ' A' ' 542' ' ' GLU . 55.8 t -64.53 144.47 14.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.684 -0.689 . . . . 71.200000000000003 111.768 -178.292 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 102.26 -25.25 28.37 Favored Glycine 0 C--N 1.332 0.307 0 CA-C-N 115.948 -0.569 . . . . 70.450000000000003 113.627 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 466' ' ' MET . 13.2 pt20 -98.23 168.35 10.29 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 117.237 0.519 . . . . 62.299999999999997 110.365 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 24.9 ttm180 -84.93 136.66 33.53 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.913 -0.403 . . . . 73.030000000000001 109.913 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 23.4 t -122.09 122.12 65.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.619 -0.511 . . . . 70.519999999999996 109.619 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.55 ' HG2' HG23 ' A' ' 513' ' ' ILE . 49.5 mt-10 -116.54 128.47 55.46 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.74 0.305 . . . . 72.200000000000003 110.56 -178.3 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.714 ' HD2' HD23 ' A' ' 512' ' ' LEU . 20.0 m-85 -105.06 127.15 52.75 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.327 -0.62 . . . . 65.409999999999997 109.327 179.069 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -111.55 116.75 31.36 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.109 0.481 . . . . 70.219999999999999 110.048 176.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 25.9 p -138.74 158.21 44.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.678 -0.692 . . . . 62.229999999999997 110.042 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.511 ' HB3' ' HG2' ' A' ' 509' ' ' ARG . 7.8 pt-20 -161.24 170.55 20.04 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.368 -0.378 . . . . 72.209999999999994 110.16 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.657 HG21 ' HB3' ' A' ' 482' ' ' ALA . 19.9 m -126.16 168.48 19.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.641 -0.708 . . . . 73.219999999999999 109.827 177.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 7.8 t -81.26 -1.05 43.49 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.439 -0.346 . . . . 42.109999999999999 111.322 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -117.2 133.96 55.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.087 0.47 . . . . 73.409999999999997 110.691 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -71.75 124.78 25.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 74.420000000000002 111.668 -175.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 71.72 31.91 64.62 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.108 -0.568 . . . . 71.120000000000005 113.284 174.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.657 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -81.56 133.37 35.37 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 122.607 -0.349 . . . . 74.430000000000007 110.535 176.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -68.23 142.49 55.62 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.695 -0.684 . . . . 74.439999999999998 110.395 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.524 HG12 HG22 ' A' ' 529' ' ' THR . 27.4 m -124.9 146.34 30.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.198 0.523 . . . . 71.099999999999994 110.76 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -117.9 135.53 54.05 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.412 -0.813 . . . . 74.430000000000007 109.053 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 486' ' ' TRP . . . . . 0.577 ' HB3' HD12 ' A' ' 493' ' ' LEU . 99.2 m95 -98.05 121.42 39.95 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.219 0.533 . . . . 75.049999999999997 110.312 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 20.2 tp -116.11 151.68 35.13 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.409 -0.814 . . . . 73.010000000000005 109.292 -178.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -136.86 105.22 5.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.803 0.335 . . . . 73.340000000000003 110.454 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 16.0 t70 47.13 40.22 9.49 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.326 -0.852 . . . . 74.439999999999998 111.663 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.47 -26.3 24.38 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.808 -0.711 . . . . 71.439999999999998 113.212 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 57.9 t -91.64 135.82 26.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 110.032 -0.359 . . . . 51.5 110.032 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -83.53 136.08 34.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.522 0.201 . . . . 75.519999999999996 110.564 -177.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.577 HD12 ' HB3' ' A' ' 486' ' ' TRP . 70.1 mt -69.09 153.89 42.98 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.946 -0.39 . . . . 72.219999999999999 109.946 178.053 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 494' ' ' THR . . . . . 0.522 HG22 ' HG2' ' A' ' 496' ' ' GLU . 1.3 m -74.98 142.19 43.92 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.19 0.519 . . . . 74.400000000000006 112.104 -170.256 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 10.6 ptp85 -68.44 -20.75 64.66 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.744 -0.662 . . . . 75.040000000000006 110.431 175.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 496' ' ' GLU . . . . . 0.522 ' HG2' HG22 ' A' ' 494' ' ' THR . 9.1 pt-20 -116.52 39.11 3.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.278 -0.874 . . . . 73.140000000000001 109.204 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 497' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 494' ' ' THR . 7.3 tp10 -62.85 154.88 28.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.192 -0.913 . . . . 70.540000000000006 111.568 -174.104 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 9.6 t -60.22 150.6 29.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.511 -0.768 . . . . 73.439999999999998 111.396 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -86.23 18.25 3.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.002 -0.544 . . . . 71.219999999999999 111.248 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 500' ' ' LYS . . . . . 0.418 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 39.6 tttp -72.61 -24.24 61.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.358 -0.608 . . . . 71.099999999999994 109.358 177.408 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.483 ' CB ' ' HA ' ' A' ' 514' ' ' ILE . 13.4 p90 -146.14 138.52 25.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.285 -0.871 . . . . 64.209999999999994 108.96 173.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -135.39 160.24 39.05 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.855 0.359 . . . . 70.140000000000001 111.446 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 503' ' ' PHE . . . . . 0.439 ' HB3' HD13 ' A' ' 512' ' ' LEU . 40.8 p90 -119.17 138.26 53.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.115 0.483 . . . . 75.340000000000003 110.734 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -116.89 131.4 56.96 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.707 -0.678 . . . . 60.229999999999997 110.274 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -101.53 128.47 47.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.419 -0.355 . . . . 71.25 110.653 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -135.56 81.75 1.91 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.075 -0.511 . . . . 64.049999999999997 109.742 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 75.14 -118.0 5.47 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 121.007 -0.616 . . . . 75.049999999999997 112.151 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -86.11 -13.88 45.9 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.94 0.4 . . . . 75.310000000000002 110.407 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.511 ' HG2' ' HB3' ' A' ' 476' ' ' GLU . 70.6 mtt180 -97.58 139.14 33.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.408 0.623 . . . . 74.140000000000001 111.497 -174.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -130.44 119.18 22.29 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.401 -0.818 . . . . 70.219999999999999 109.638 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 41.7 m-70 -105.54 124.91 50.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.438 -0.346 . . . . 63.43 110.189 -177.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.714 HD23 ' HD2' ' A' ' 473' ' ' PHE . 50.6 tp -106.31 105.86 16.1 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.696 -0.483 . . . . 71.030000000000001 109.696 176.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.55 HG23 ' HG2' ' A' ' 472' ' ' GLU . 4.8 mp -101.75 110.6 28.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 116.187 -0.461 . . . . 71.329999999999998 110.622 -174.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.483 ' HA ' ' CB ' ' A' ' 501' ' ' TYR . 55.4 mt -92.4 116.99 34.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 108.575 -0.898 . . . . 74.5 108.575 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -70.64 -42.76 70.43 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.1 -0.5 . . . . 61.240000000000002 111.345 -175.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 516' ' ' GLU . . . . . 0.418 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 26.2 mt-10 -134.17 105.24 6.56 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.871 -0.604 . . . . 63.420000000000002 109.627 -178.162 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.469 ' O ' HG13 ' A' ' 467' ' ' VAL . . . -56.53 123.04 13.43 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.548 0.53 . . . . 60.109999999999999 110.306 177.388 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 14.4 tpt -113.81 169.09 9.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.133 -0.485 . . . . 73.209999999999994 110.111 -175.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 1.004 ' HG ' ' HG2' ' A' ' 542' ' ' GLU . 7.2 mp -58.12 -33.04 68.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.108 0.48 . . . . 55.509999999999998 110.491 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -60.91 -32.48 71.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.473 -0.785 . . . . 74.140000000000001 112.233 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -69.32 -14.23 62.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.766 0.317 . . . . 75.299999999999997 111.818 -172.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -62.71 -23.23 67.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.086 0.469 . . . . 74.200000000000003 110.088 172.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -67.54 123.73 20.35 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.824 -0.91 . . . . 23.210000000000001 110.824 173.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -66.76 125.74 26.82 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.127 0.489 . . . . 45.119999999999997 111.694 -170.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -92.95 152.48 19.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.594 -0.73 . . . . 65.140000000000001 110.522 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.51 143.24 43.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.965 -0.561 . . . . 74.099999999999994 110.744 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.499 ' HB2' HD21 ' A' ' 460' ' ' LEU . 58.6 tp -100.97 114.13 27.75 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.049 -0.523 . . . . 61.32 109.907 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 42.3 t -112.89 128.82 56.57 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.191 -0.459 . . . . 63.399999999999999 110.08 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.524 HG22 HG12 ' A' ' 484' ' ' VAL . 75.8 p -114.69 -174.3 2.46 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.492 -0.559 . . . . 74.109999999999999 109.492 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 12.4 p -68.0 -8.93 41.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.65 -0.25 . . . . 60.200000000000003 111.575 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -143.68 -48.55 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.705 -0.759 . . . . 21.329999999999998 113.301 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -98.74 156.97 20.22 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.646 -0.788 . . . . 54.0 113.121 -174.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -131.99 125.43 31.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.368 0.267 . . . . 73.329999999999998 110.292 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 534' ' ' ALA . . . . . 0.588 ' HB2' HG13 ' A' ' 456' ' ' ILE . . . -121.53 118.1 28.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.708 -0.224 . . . . 53.43 110.791 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 64.0 tp -109.66 138.96 45.27 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.996 0.427 . . . . 74.409999999999997 110.622 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -139.52 145.17 38.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.758 -0.656 . . . . 24.399999999999999 109.557 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -105.63 110.0 22.16 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.544 0.688 . . . . 73.310000000000002 110.458 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.559 HD11 HG22 ' A' ' 465' ' ' VAL . 49.1 tp -103.39 132.58 49.53 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.534 -0.757 . . . . 72.200000000000003 110.037 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.555 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 67.8 mt -117.85 112.92 40.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.723 -0.473 . . . . 72.519999999999996 109.723 176.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.438 HG22 HG23 ' A' ' 465' ' ' VAL . 45.8 t -108.39 108.65 25.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.302 -0.408 . . . . 75.409999999999997 110.244 -179.212 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -85.55 134.08 34.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.921 0.391 . . . . 63.43 110.41 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 542' ' ' GLU . . . . . 1.004 ' HG2' ' HG ' ' A' ' 519' ' ' LEU . 1.0 OUTLIER -83.95 149.82 26.06 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.706 -0.679 . . . . 62.229999999999997 111.404 -174.325 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 C--O 1.249 1.046 0 CA-C-N 115.58 -0.736 . . . . 75.209999999999994 109.532 175.234 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo . . . . . 0 C--O 1.234 0.275 0 CA-C-O 121.003 0.335 . . . . 62.399999999999999 112.494 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.452 ' H ' ' HA3' ' A' ' 531' ' ' GLY . 57.3 t -66.87 116.11 5.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.982 -0.553 . . . . 73.510000000000005 109.583 175.524 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.31 153.14 17.82 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.045 0.45 . . . . 70.239999999999995 110.977 -174.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.416 HG22 ' H ' ' A' ' 458' ' ' ARG . 27.7 mm -105.76 117.83 52.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.785 -0.643 . . . . 74.140000000000001 109.733 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 457' ' ' THR . . . . . 0.58 ' CG2' ' HB2' ' A' ' 476' ' ' GLU . 15.1 t -91.26 2.63 56.23 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.271 0.558 . . . . 65.329999999999998 110.763 -177.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.428 ' HB2' ' H ' ' A' ' 476' ' ' GLU . 75.4 mmt-85 -138.84 94.5 10.14 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.708 -0.678 . . . . 71.209999999999994 109.663 173.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -67.45 157.31 62.37 Favored 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.479 2.12 . . . . 70.319999999999993 111.467 178.264 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.434 HD12 ' HB3' ' A' ' 473' ' ' PHE . 3.1 mm? -80.96 146.66 30.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.357 -0.609 . . . . 53.299999999999997 109.357 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 461' ' ' GLU . . . . . 0.657 ' HB2' ' OE1' ' A' ' 463' ' ' GLN . 6.0 pt-20 -82.91 126.77 32.86 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.968 0.889 . . . . 73.120000000000005 112.462 -171.07 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -92.55 -6.94 48.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 113.934 -1.485 . . . . 64.25 112.791 -173.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 463' ' ' GLN . . . . . 0.657 ' OE1' ' HB2' ' A' ' 461' ' ' GLU . 4.6 pm0 -83.73 161.33 21.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.294 0.569 . . . . 75.200000000000003 110.954 -169.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.834 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 1.2 tt -84.72 132.1 34.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.339 -0.846 . . . . 63.200000000000003 111.609 -161.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 33.0 m -120.81 177.73 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.357 -0.838 . . . . 63.0 109.693 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' MET . . . . . 0.453 ' O ' ' HB3' ' A' ' 469' ' ' GLN . 23.0 ptp -124.5 163.11 22.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.696 0.284 . . . . 75.010000000000005 111.017 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 467' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 541' ' ' GLN . 59.6 t -62.53 130.31 26.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 70.129999999999995 111.179 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 468' ' ' GLY . . . . . 0.445 ' HA2' ' HB3' ' A' ' 516' ' ' GLU . . . 93.48 -11.88 70.65 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.937 -0.649 . . . . 72.430000000000007 112.353 178.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.453 ' HB3' ' O ' ' A' ' 466' ' ' MET . 29.5 tt0 -76.31 132.37 39.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.951 0.405 . . . . 72.120000000000005 111.035 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -73.86 127.04 31.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.609 -0.723 . . . . 74.040000000000006 110.251 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 47.5 t -132.52 126.86 55.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.202 -0.454 . . . . 65.239999999999995 110.601 -178.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -103.86 131.07 51.42 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.126 -0.324 . . . . 72.340000000000003 110.126 174.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.434 ' HB3' HD12 ' A' ' 460' ' ' LEU . 55.0 m-85 -107.07 110.98 23.24 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.124 -0.489 . . . . 71.430000000000007 109.748 176.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -104.97 129.86 53.29 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.346 -0.388 . . . . 73.409999999999997 110.296 -178.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 9.0 p -143.46 111.68 6.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.219 0.533 . . . . 64.129999999999995 110.292 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.58 ' HB2' ' CG2' ' A' ' 457' ' ' THR . 2.0 mm-40 -108.51 132.23 54.03 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.125 -0.694 . . . . 74.239999999999995 109.125 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.458 HG22 ' O ' ' A' ' 508' ' ' GLN . 34.9 m -95.33 144.64 9.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 110.044 -0.354 . . . . 63.399999999999999 110.044 179.374 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 58.9 p -85.79 -2.59 58.38 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.81 0.338 . . . . 63.219999999999999 111.446 -177.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -124.04 133.16 53.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.334 -0.394 . . . . 73.109999999999999 110.222 -178.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -77.98 150.13 33.98 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.018 -0.364 . . . . 65.430000000000007 110.018 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 84.41 16.29 66.86 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.495 -0.859 . . . . 41.340000000000003 112.116 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.44 110.89 22.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.964 0.411 . . . . 72.010000000000005 110.535 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 483' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 529' ' ' THR . 27.2 mp0 -80.97 157.92 25.37 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.126 -0.694 . . . . 71.120000000000005 109.126 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.554 HG12 HG22 ' A' ' 529' ' ' THR . 24.5 m -128.1 143.16 41.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.246 0.546 . . . . 62.210000000000001 111.579 -175.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 485' ' ' LYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 21.5 ttmm -127.59 131.69 49.92 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.404 -0.816 . . . . 72.25 109.37 174.18 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 486' ' ' TRP . . . . . 0.462 ' HB2' HD11 ' A' ' 493' ' ' LEU . 98.0 m95 -98.17 115.91 29.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.303 0.573 . . . . 74.219999999999999 110.258 178.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 37.3 tp -116.63 120.89 40.08 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.342 -0.844 . . . . 73.219999999999999 109.501 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.473 ' HE2' ' HA3' ' A' ' 523' ' ' GLY . 13.3 tmtt? -109.44 106.65 16.49 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.466 -0.494 . . . . 73.400000000000006 110.311 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.08 38.31 20.36 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.164 -0.926 . . . . 73.299999999999997 111.808 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.73 -24.16 32.12 Favored Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.87 -0.681 . . . . 71.140000000000001 112.586 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.6 t -89.7 124.84 42.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 110.072 -0.344 . . . . 64.120000000000005 110.072 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -89.62 119.66 30.24 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.428 -0.582 . . . . 64.239999999999995 109.428 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.462 HD11 ' HB2' ' A' ' 486' ' ' TRP . 2.4 pp -72.73 161.64 30.49 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.199 -0.455 . . . . 65.120000000000005 111.395 -177.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 494' ' ' THR . . . . . 0.5 ' O ' ' HB2' ' A' ' 497' ' ' GLU . 19.1 m -106.85 142.72 36.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.98 -0.554 . . . . 75.420000000000002 110.241 -178.839 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 495' ' ' ARG . . . . . 0.415 ' HD3' ' C ' ' A' ' 495' ' ' ARG . 4.3 tmt_? -65.19 -39.91 93.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.345 -0.613 . . . . 64.349999999999994 109.345 176.308 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 496' ' ' GLU . . . . . 0.439 ' H ' HG22 ' A' ' 494' ' ' THR . 1.3 mp0 -76.25 73.14 3.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.936 -0.575 . . . . 62.229999999999997 109.898 171.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 497' ' ' GLU . . . . . 0.5 ' HB2' ' O ' ' A' ' 494' ' ' THR . 5.0 tp10 -120.21 179.58 4.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.585 -0.734 . . . . 75.230000000000004 109.44 -177.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.426 ' H ' ' HG3' ' A' ' 497' ' ' GLU . 11.2 t -72.5 172.64 10.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.703 0.287 . . . . 72.549999999999997 110.345 175.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -79.13 18.21 0.68 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.816 0.341 . . . . 72.409999999999997 111.791 -173.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -61.4 -35.13 76.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 72.349999999999994 111.189 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.534 ' HD2' HD11 ' A' ' 512' ' ' LEU . 25.1 p90 -148.57 150.2 32.92 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.297 -0.411 . . . . 74.219999999999999 110.616 -177.301 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -146.6 142.64 28.16 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.479 -0.563 . . . . 72.450000000000003 109.479 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 503' ' ' PHE . . . . . 0.51 ' HB3' HD13 ' A' ' 512' ' ' LEU . 44.1 p90 -123.3 150.03 44.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.131 0.491 . . . . 74.329999999999998 111.34 -176.273 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -127.92 139.7 52.44 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.368 -0.833 . . . . 64.109999999999999 110.023 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.2 pptp? -111.07 137.78 48.3 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.691 -0.485 . . . . 75.430000000000007 109.691 173.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 506' ' ' ASP . . . . . 0.633 ' HB3' ' HB2' ' A' ' 509' ' ' ARG . 33.8 t70 -130.45 82.86 2.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.784 -0.644 . . . . 75.25 109.382 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.34 -107.99 2.25 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.704 -0.76 . . . . 65.340000000000003 111.661 -174.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.458 ' O ' HG22 ' A' ' 477' ' ' VAL . 15.9 pt20 -89.32 -7.44 55.33 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.454 0.645 . . . . 74.109999999999999 110.151 177.186 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.633 ' HB2' ' HB3' ' A' ' 506' ' ' ASP . 67.8 mtp180 -91.08 147.12 23.29 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.641 -0.709 . . . . 71.439999999999998 111.071 -172.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -141.72 115.72 9.29 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.36 -0.607 . . . . 75.319999999999993 109.36 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -124.33 122.51 37.91 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.68 0.276 . . . . 64.319999999999993 110.574 -175.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.534 HD11 ' HD2' ' A' ' 501' ' ' TYR . 57.4 tp -107.86 126.54 52.79 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.137 -0.483 . . . . 52.020000000000003 110.315 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.42 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.2 mp -108.76 113.84 45.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 120.954 0.406 . . . . 73.439999999999998 110.737 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 514' ' ' ILE . . . . . . . . . . . . . 35.5 mm -91.36 121.84 42.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.874 -0.787 . . . . 72.409999999999997 108.874 174.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -66.64 -51.49 55.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.81 0.338 . . . . 72.239999999999995 110.397 -177.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 516' ' ' GLU . . . . . 0.445 ' HB3' ' HA2' ' A' ' 468' ' ' GLY . 46.4 mt-10 -145.4 123.55 12.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.917 -0.583 . . . . 72.450000000000003 110.131 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -66.48 133.71 50.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.128 -0.487 . . . . 50.340000000000003 110.999 178.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 518' ' ' MET . . . . . 0.449 ' HG2' ' H ' ' A' ' 520' ' ' GLU . 55.1 ttm -113.67 155.96 24.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.891 -0.595 . . . . 75.439999999999998 109.621 -178.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.702 HD21 ' HB3' ' A' ' 542' ' ' GLU . 84.8 mt -58.81 -32.5 69.43 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.935 0.397 . . . . 51.240000000000002 111.623 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 520' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' A' ' 518' ' ' MET . 0.9 OUTLIER -60.41 -28.58 68.37 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.143 0.497 . . . . 74.010000000000005 110.691 178.454 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 521' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 523' ' ' GLY . 56.7 m-20 -71.32 -11.95 61.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.767 -0.651 . . . . 74.430000000000007 112.197 -175.244 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.489 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -61.66 5.54 0.08 Allowed 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.576 0.584 . . . . 72.019999999999996 112.576 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 523' ' ' GLY . . . . . 0.473 ' HA3' ' HE2' ' A' ' 488' ' ' LYS . . . -83.91 170.56 47.81 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 116.415 -0.357 . . . . 71.150000000000006 112.367 177.081 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 44.4 m-70 -73.69 118.56 16.79 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 122.65 -0.324 . . . . 72.209999999999994 110.559 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 525' ' ' TYR . . . . . 0.441 ' HB2' ' O ' ' A' ' 536' ' ' ALA . 56.8 m-85 -83.75 133.73 34.77 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.957 -0.386 . . . . 72.450000000000003 109.957 172.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.57 134.23 46.84 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.867 0.365 . . . . 70.140000000000001 110.514 175.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.548 HD11 ' HB ' ' A' ' 484' ' ' VAL . 57.1 tp -110.33 106.52 15.93 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.866 -0.606 . . . . 72.400000000000006 109.939 177.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 528' ' ' CYS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 48.7 m -92.52 115.11 27.8 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.218 -0.446 . . . . 73.420000000000002 110.113 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.554 HG22 HG12 ' A' ' 484' ' ' VAL . 44.3 p -109.11 -175.01 2.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.909 0.385 . . . . 73.540000000000006 110.601 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 14.5 m -72.65 -5.92 40.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.082 -0.508 . . . . 74.319999999999993 110.965 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 531' ' ' GLY . . . . . 0.452 ' HA3' ' H ' ' A' ' 454' ' ' VAL . . . -138.43 -90.38 0.22 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.653 -0.784 . . . . 75.219999999999999 112.785 -178.106 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -97.46 127.28 9.16 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.631 -0.795 . . . . 51.200000000000003 112.455 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -95.55 127.1 41.31 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.059 0.457 . . . . 71.140000000000001 110.814 178.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -97.23 140.03 32.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.006 -0.543 . . . . 72.409999999999997 110.044 178.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 6.0 tt -129.58 123.78 32.18 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.724 -0.473 . . . . 75.299999999999997 109.724 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.441 ' O ' ' HB2' ' A' ' 525' ' ' TYR . . . -145.07 134.76 23.43 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.724 -0.671 . . . . 74.400000000000006 109.687 177.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 537' ' ' GLU . . . . . 0.438 ' H ' ' HG2' ' A' ' 537' ' ' GLU . 4.4 pt-20 -105.17 137.72 42.5 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 120.844 0.354 . . . . 73.019999999999996 110.474 -176.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 522' ' ' ALA . 45.4 tp -96.4 133.95 40.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.879 -0.601 . . . . 60.219999999999999 110.201 -174.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.834 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 7.6 mt -104.06 123.78 58.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.98 -0.748 . . . . 63.43 108.98 177.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 45.6 t -118.74 126.37 75.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.584 -0.28 . . . . 75.109999999999999 111.22 -174.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 541' ' ' GLN . . . . . 0.574 ' HG3' ' CD2' ' A' ' 464' ' ' LEU . 74.8 mt-30 -84.82 127.73 34.28 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 116.361 -0.381 . . . . 73.129999999999995 111.189 175.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 542' ' ' GLU . . . . . 0.702 ' HB3' HD21 ' A' ' 519' ' ' LEU . 6.9 pt-20 -91.12 126.81 36.32 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.512 -1.292 . . . . 74.219999999999999 107.512 163.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp . . . . . 0 C--N 1.315 -0.92 0 CA-C-O 118.865 -0.588 . . . . 62.240000000000002 109.736 -176.609 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo . . . . . 0 N--CA 1.462 -0.38 0 CA-C-O 120.797 0.249 . . . . 71.209999999999994 111.794 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.418 ' H ' ' HA3' ' A' ' 531' ' ' GLY . 43.1 t -66.26 106.34 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.112 -0.494 . . . . 63.409999999999997 110.219 -177.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 93.6 mt -82.57 147.29 28.7 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.605 -0.725 . . . . 73.409999999999997 110.163 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.788 HG13 ' HB2' ' A' ' 534' ' ' ALA . 40.7 mm -94.79 117.35 38.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.942 -0.572 . . . . 73.409999999999997 109.908 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 457' ' ' THR . . . . . 0.496 HG22 ' NH2' ' A' ' 458' ' ' ARG . 3.3 m -83.28 -35.63 25.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.218 -0.447 . . . . 70.340000000000003 110.583 -177.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.717 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 14.2 mmp_? -115.42 105.57 52.04 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 109.566 -0.531 . . . . 74.120000000000005 109.566 176.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -70.75 160.61 48.85 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.784 2.323 . . . . 64.219999999999999 111.785 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.481 ' HB2' ' CB ' ' A' ' 536' ' ' ALA . 94.8 mt -81.77 169.4 16.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.763 0.316 . . . . 65.329999999999998 110.98 -177.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -64.7 118.12 8.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.961 -0.563 . . . . 43.130000000000003 111.444 -175.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -94.76 -11.75 28.43 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.865 -0.607 . . . . 72.420000000000002 111.503 177.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -89.51 159.73 17.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.196 0.522 . . . . 74.239999999999995 111.778 -171.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.41 ' C ' HD23 ' A' ' 464' ' ' LEU . 8.4 tt -85.81 137.06 33.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.51 -0.768 . . . . 74.319999999999993 110.258 -173.219 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.628 HG23 HG23 ' A' ' 540' ' ' VAL . 22.8 m -130.45 175.99 9.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.623 -0.717 . . . . 64.439999999999998 110.476 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 466' ' ' MET . . . . . 0.493 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 65.8 mtt -111.21 150.74 29.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.638 0.256 . . . . 70.5 110.975 -178.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.5 142.56 16.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.303 -0.408 . . . . 41.43 110.72 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.06 -25.49 28.12 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.946 -0.645 . . . . 42.219999999999999 113.635 175.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 466' ' ' MET . 13.1 pt20 -89.26 164.82 14.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.25 0.525 . . . . 64.439999999999998 110.444 -178.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 470' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 514' ' ' ILE . 33.9 ttm180 -88.81 129.39 35.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.909 0.385 . . . . 71.549999999999997 111.215 -174.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -124.92 139.92 49.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.495 . . . . 72.109999999999999 110.206 -177.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -125.69 134.12 51.93 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.753 0.311 . . . . 55.420000000000002 110.643 -178.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.767 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 81.8 m-85 -107.12 116.32 31.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.207 -0.451 . . . . 70.040000000000006 110.625 177.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -100.06 118.14 35.81 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.628 -0.715 . . . . 71.239999999999995 109.606 177.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.717 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 27.6 t -134.89 141.29 46.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.299 0.571 . . . . 64.340000000000003 111.305 -178.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.621 ' HG3' ' HG2' ' A' ' 509' ' ' ARG . 42.7 tt0 -138.45 136.85 36.62 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.298 -1.001 . . . . 74.340000000000003 108.298 176.016 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.531 HG21 ' HB3' ' A' ' 482' ' ' ALA . 18.0 m -104.07 154.68 5.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 C-N-CA 121.167 -0.213 . . . . 64.219999999999999 110.459 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 45.4 m -82.61 -2.22 53.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.814 0.34 . . . . 74.209999999999994 111.622 -178.062 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -111.21 141.29 44.92 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.612 -0.514 . . . . 73.140000000000001 109.612 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -86.24 138.41 31.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.153 -0.476 . . . . 74.420000000000002 111.202 -173.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 62.13 39.1 97.2 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.922 -0.656 . . . . 65.430000000000007 112.212 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.531 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -103.34 112.03 24.72 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.078 0.466 . . . . 71.140000000000001 111.065 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -73.31 154.31 40.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.594 -0.73 . . . . 73.329999999999998 109.594 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.423 HG12 HG22 ' A' ' 529' ' ' THR . 35.7 m -124.63 161.26 28.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.897 0.379 . . . . 72.549999999999997 111.022 -175.499 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 485' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 527' ' ' LEU . 12.3 ttmm -116.64 128.77 55.69 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.731 -0.668 . . . . 44.450000000000003 109.682 177.342 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 486' ' ' TRP . . . . . 0.41 ' HB2' HD21 ' A' ' 493' ' ' LEU . 89.9 m95 -98.82 115.35 28.61 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.306 -0.627 . . . . 75.530000000000001 109.306 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 28.6 tp -119.6 119.2 33.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.032 -0.531 . . . . 63.109999999999999 110.393 -177.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.481 ' HD3' ' O ' ' A' ' 488' ' ' LYS . 13.3 tmtt? -109.74 106.79 16.56 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.013 -0.366 . . . . 71.329999999999998 110.013 177.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.1 t70 49.19 38.46 13.32 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.461 0.648 . . . . 74.209999999999994 111.491 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.45 -17.21 58.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.707 -0.759 . . . . 64.120000000000005 113.014 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.6 t -84.89 117.14 29.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.803 0.302 . . . . 74.340000000000003 110.729 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -97.89 117.67 32.75 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.44 -0.578 . . . . 53.530000000000001 109.44 176.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.41 HD21 ' HB2' ' A' ' 486' ' ' TRP . 1.9 pp -73.97 163.11 28.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.177 0.513 . . . . 73.540000000000006 112.008 -175.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 34.9 p -106.72 174.42 5.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.619 -0.719 . . . . 70.120000000000005 111.541 -177.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -63.14 -47.47 82.58 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.324 0.583 . . . . 75.219999999999999 111.202 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -95.52 50.51 1.24 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.824 -0.625 . . . . 74.329999999999998 110.23 -176.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -76.45 169.75 17.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.905 -0.589 . . . . 72.319999999999993 110.649 -176.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 4.7 t -57.75 150.97 18.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.155 0.502 . . . . 55.509999999999998 111.898 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -85.19 7.21 22.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.862 -0.608 . . . . 72.120000000000005 111.123 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 500' ' ' LYS . . . . . 0.485 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 54.3 tptt -62.06 -37.34 84.63 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.483 0.659 . . . . 75.0 109.337 174.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.519 ' HB2' HG12 ' A' ' 514' ' ' ILE . 8.4 p90 -152.19 131.64 12.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.954 -1.021 . . . . 71.540000000000006 108.681 175.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -139.0 161.51 37.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.096 0.474 . . . . 72.120000000000005 111.755 -175.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -119.0 139.64 51.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.834 -0.621 . . . . 70.349999999999994 110.755 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.427 ' HE2' ' HB3' ' A' ' 504' ' ' LYS . 40.7 mtpt -127.59 149.69 50.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.11 -0.495 . . . . 75.109999999999999 109.921 176.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.456 ' HD3' ' O ' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -106.62 146.9 30.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.2 0.524 . . . . 73.319999999999993 111.478 -176.108 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -147.31 99.07 3.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.361 -0.836 . . . . 63.009999999999998 109.546 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 61.83 -123.65 32.16 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.453 -0.88 . . . . 51.25 111.107 -173.776 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -96.92 7.34 46.85 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.172 0.51 . . . . 74.430000000000007 110.423 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.621 ' HG2' ' HG3' ' A' ' 476' ' ' GLU . 74.8 mtm180 -95.26 152.29 18.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.044 -0.525 . . . . 60.32 110.032 177.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -136.94 128.25 28.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.966 -0.383 . . . . 50.329999999999998 109.966 -178.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -111.01 123.91 51.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.515 -0.311 . . . . 63.130000000000003 110.198 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.767 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 58.2 tp -110.28 104.47 13.28 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.511 -0.551 . . . . 45.299999999999997 109.511 174.56 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.432 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.3 mp -101.38 115.55 43.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.239 -0.437 . . . . 73.0 110.515 -175.516 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.527 ' O ' ' HG3' ' A' ' 470' ' ' ARG . 51.8 mt -97.74 119.42 45.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.898 -0.779 . . . . 75.540000000000006 108.898 173.313 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -69.1 -39.56 78.9 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.366 -0.379 . . . . 73.230000000000004 110.88 -177.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 516' ' ' GLU . . . . . 0.485 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 41.4 mt-10 -146.83 113.17 5.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.908 -0.587 . . . . 71.120000000000005 109.617 178.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -58.43 143.23 46.08 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 123.517 0.511 . . . . 71.129999999999995 111.385 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 88.0 mtp -123.38 172.9 8.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.102 -0.499 . . . . 64.019999999999996 110.301 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.477 ' O ' HD13 ' A' ' 519' ' ' LEU . 2.6 tm? -60.7 -31.36 70.64 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.956 -0.387 . . . . 65.540000000000006 109.956 177.697 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -52.44 -28.62 20.76 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.073 -0.512 . . . . 71.129999999999995 111.87 177.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 521' ' ' ASP . . . . . 0.556 ' HA ' ' HE1' ' A' ' 525' ' ' TYR . 42.6 m-20 -68.16 -15.38 63.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.379 -0.373 . . . . 73.030000000000001 111.802 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.52 ' HB2' HG12 ' A' ' 540' ' ' VAL . . . -71.04 -12.86 61.76 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.13 0.49 . . . . 73.150000000000006 110.225 174.062 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -77.66 156.53 44.6 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 111.138 -0.785 . . . . 30.530000000000001 111.138 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -81.79 117.19 21.89 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.189 0.518 . . . . 64.519999999999996 111.044 -176.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 525' ' ' TYR . . . . . 0.556 ' HE1' ' HA ' ' A' ' 521' ' ' ASP . 73.4 m-85 -88.96 133.76 34.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.205 -0.907 . . . . 74.239999999999995 110.667 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -123.59 135.02 53.74 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.081 -0.509 . . . . 73.25 110.36 176.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.434 ' HA ' ' O ' ' A' ' 485' ' ' LYS . 9.4 tt -109.8 111.0 22.17 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.883 -0.784 . . . . 74.129999999999995 108.883 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 42.1 t -109.5 136.31 49.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.29 -0.414 . . . . 71.200000000000003 110.721 -176.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.423 HG22 HG12 ' A' ' 484' ' ' VAL . 82.3 p -118.22 -175.65 2.9 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.69 -0.485 . . . . 73.400000000000006 109.69 175.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 13.7 m -69.18 -9.08 51.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.761 0.315 . . . . 74.310000000000002 110.942 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 531' ' ' GLY . . . . . 0.418 ' HA3' ' H ' ' A' ' 454' ' ' VAL . . . -124.85 -65.97 0.19 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.395 -0.907 . . . . 75.219999999999999 112.896 -177.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -113.52 171.45 13.84 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.676 -0.773 . . . . 61.100000000000001 112.498 -176.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -138.62 130.34 27.78 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.775 0.321 . . . . 71.099999999999994 110.561 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 534' ' ' ALA . . . . . 0.788 ' HB2' HG13 ' A' ' 456' ' ' ILE . . . -109.47 120.97 44.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.209 -0.451 . . . . 72.140000000000001 110.157 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 5.3 tt -109.05 121.2 44.64 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.093 -0.706 . . . . 64.230000000000004 109.093 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.481 ' CB ' ' HB2' ' A' ' 460' ' ' LEU . . . -119.2 132.13 55.91 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.065 0.46 . . . . 73.329999999999998 110.478 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -99.46 108.73 21.26 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.38 0.61 . . . . 73.430000000000007 109.691 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.453 HD23 ' HB3' ' A' ' 521' ' ' ASP . 37.0 tp -97.78 136.1 38.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.331 -0.85 . . . . 75.200000000000003 109.459 -177.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 31.5 mt -113.03 112.36 40.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.84 -0.43 . . . . 63.25 109.84 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.628 HG23 HG23 ' A' ' 465' ' ' VAL . 4.4 p -113.91 133.34 60.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 108.803 -0.814 . . . . 73.25 108.803 176.244 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -110.21 148.18 32.34 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.107 0.479 . . . . 73.400000000000006 111.407 -176.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.36 146.97 50.1 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.012 -0.994 . . . . 60.109999999999999 110.786 -178.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 543' ' ' LYS . . . . . 0.46 ' HD2' ' HB3' ' A' ' 466' ' ' MET . 55.9 mtpt . . . . . 0 C--O 1.244 0.803 0 CA-C-O 118.629 -0.7 . . . . 72.239999999999995 109.323 175.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo . . . . . 0 N--CA 1.464 -0.247 0 CA-C-O 120.956 0.315 . . . . 51.43 112.068 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.68 132.35 32.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.991 -0.55 . . . . 74.109999999999999 110.674 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.9 137.26 34.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.922 -0.581 . . . . 73.519999999999996 110.857 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.566 HD13 HG12 ' A' ' 477' ' ' VAL . 32.9 mm -95.43 119.08 43.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.734 -0.666 . . . . 73.340000000000003 109.717 177.777 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 457' ' ' THR . . . . . 0.783 ' HB ' ' HG3' ' A' ' 476' ' ' GLU . 7.5 m -86.89 -23.54 25.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 73.209999999999994 111.18 -177.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.824 ' HG2' ' HG2' ' A' ' 476' ' ' GLU . 22.5 mmt180 -123.35 117.32 28.04 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.598 -0.274 . . . . 65.329999999999998 111.671 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -83.42 167.12 13.71 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 123.02 2.48 . . . . 75.420000000000002 111.414 173.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -89.49 169.96 10.92 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.617 0.246 . . . . 40.329999999999998 110.87 -178.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -71.18 118.64 14.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.275 -0.42 . . . . 65.209999999999994 110.453 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -93.94 -13.47 27.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.171 -0.468 . . . . 64.019999999999996 111.27 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -89.66 155.32 19.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.136 0.493 . . . . 62.009999999999998 111.131 -173.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 8.0 tt -88.95 133.13 34.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.708 -0.678 . . . . 70.319999999999993 110.352 -173.71 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 28.7 m -127.49 176.67 6.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 63.210000000000001 111.035 -177.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 26.4 mmt -113.86 152.91 30.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.323 -0.399 . . . . 75.409999999999997 111.272 -176.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 467' ' ' VAL . . . . . 0.408 HG13 ' O ' ' A' ' 517' ' ' ALA . 83.1 t -68.14 144.69 14.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.549 -0.751 . . . . 71.010000000000005 110.787 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.52 -2.26 53.39 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.911 -0.661 . . . . 45.240000000000002 113.973 175.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -114.57 164.34 14.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.471 0.636 . . . . 54.020000000000003 110.475 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 27.2 ttt85 -84.92 132.88 34.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.975 0.417 . . . . 74.540000000000006 111.166 -177.332 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.494 ' O ' ' HB ' ' A' ' 514' ' ' ILE . 50.5 t -131.67 138.57 52.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.862 -0.608 . . . . 52.420000000000002 109.605 177.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -131.78 139.44 48.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.778 0.323 . . . . 64.219999999999999 110.461 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.461 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 93.5 m-85 -121.27 109.61 15.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.929 -0.578 . . . . 64.409999999999997 110.154 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -106.43 117.09 33.13 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 119.909 -0.716 . . . . 62.420000000000002 109.467 173.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.768 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 7.7 p -122.8 123.41 40.98 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.555 -0.748 . . . . 62.109999999999999 109.974 -178.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.824 ' HG2' ' HG2' ' A' ' 458' ' ' ARG . 13.3 pt-20 -125.42 145.09 50.22 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.909 0.385 . . . . 74.430000000000007 110.239 -177.095 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.566 HG12 HD13 ' A' ' 456' ' ' ILE . 17.9 m -111.49 164.63 7.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.782 -0.645 . . . . 71.319999999999993 109.543 178.054 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 15.6 t -78.16 -18.0 56.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.728 0.299 . . . . 74.140000000000001 111.214 -178.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 479' ' ' GLU . . . . . 0.41 ' O ' HG23 ' A' ' 477' ' ' VAL . 44.6 tt0 -103.31 131.94 49.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.817 0.341 . . . . 72.140000000000001 110.422 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 480' ' ' GLU . . . . . 0.517 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 43.2 tt0 -89.17 131.56 35.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.854 0.359 . . . . 60.509999999999998 110.164 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 98.78 -1.42 58.14 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.801 -0.714 . . . . 54.130000000000003 111.523 -176.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.536 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -79.57 112.01 16.41 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.055 0.455 . . . . 74.329999999999998 110.625 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -81.78 147.15 29.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.647 -0.706 . . . . 75.25 110.805 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 28.9 m -126.96 153.24 35.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.006 -0.543 . . . . 65.5 110.459 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -119.23 145.72 45.82 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.644 -0.502 . . . . 71.230000000000004 109.644 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -98.6 129.37 45.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.305 0.574 . . . . 74.510000000000005 110.909 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 487' ' ' LEU . . . . . 0.648 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 2.6 tm? -116.24 131.73 56.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.277 -0.874 . . . . 75.329999999999998 108.846 -177.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.437 ' HE3' ' HA3' ' A' ' 523' ' ' GLY . 1.2 tmtp? -120.55 107.32 12.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.898 0.38 . . . . 70.010000000000005 111.446 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 53.72 37.72 26.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.379 -0.828 . . . . 62.240000000000002 111.993 172.062 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.99 -24.04 33.01 Favored Glycine 0 CA--C 1.517 0.196 0 C-N-CA 120.751 -0.738 . . . . 63.140000000000001 112.553 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.9 t -97.28 127.87 49.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.725 0.298 . . . . 44.32 110.417 -178.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -86.65 131.85 34.04 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.82 -0.437 . . . . 63.200000000000003 109.82 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 3.3 pp -112.14 162.96 14.86 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.072 0.463 . . . . 51.140000000000001 111.256 -177.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 22.2 p -108.19 173.91 6.11 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.906 -0.588 . . . . 61.219999999999999 109.701 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 495' ' ' ARG . . . . . 0.639 ' HD3' ' CE2' ' A' ' 503' ' ' PHE . 13.9 tpt180 -80.9 -4.41 54.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.077 0.465 . . . . 63.329999999999998 110.467 -178.229 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -74.07 75.69 1.74 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.193 0.52 . . . . 73.530000000000001 110.48 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -145.47 170.7 15.87 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.824 -0.625 . . . . 74.409999999999997 109.482 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.436 HG23 ' H ' ' A' ' 500' ' ' LYS . 15.2 t -68.65 172.12 6.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.086 0.47 . . . . 63.32 111.235 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -84.7 18.53 2.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 75.450000000000003 111.931 -172.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 500' ' ' LYS . . . . . 0.436 ' H ' HG23 ' A' ' 498' ' ' THR . 13.8 tmtt? -58.09 -32.43 68.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.464 0.649 . . . . 72.109999999999999 109.785 174.277 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.621 ' HD2' HD11 ' A' ' 512' ' ' LEU . 23.0 p90 -144.44 144.11 31.23 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.467 -0.788 . . . . 65.549999999999997 109.153 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 22.2 p-90 -147.33 145.44 29.33 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.384 -0.371 . . . . 72.349999999999994 110.001 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 503' ' ' PHE . . . . . 0.639 ' CE2' ' HD3' ' A' ' 495' ' ' ARG . 44.9 p90 -126.87 151.99 47.64 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.327 -0.549 . . . . 63.549999999999997 111.651 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.539 ' NZ ' ' HB3' ' A' ' 504' ' ' LYS . 8.9 mtpm? -116.23 150.11 38.07 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.344 -0.844 . . . . 73.340000000000003 110.785 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 505' ' ' LYS . 18.5 ptpt -110.62 106.93 16.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.283 0.563 . . . . 74.540000000000006 109.804 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 506' ' ' ASP . . . . . 0.584 ' HB2' ' HG3' ' A' ' 509' ' ' ARG . 5.5 m-20 -113.82 80.3 1.36 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.23 0.538 . . . . 73.510000000000005 109.883 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.73 -96.7 0.38 Allowed Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.579 -0.737 . . . . 52.25 112.495 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.517 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 19.2 pt20 -108.09 -10.83 15.39 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.918 0.39 . . . . 73.340000000000003 111.365 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.584 ' HG3' ' HB2' ' A' ' 506' ' ' ASP . 5.2 ptp180 -102.74 136.3 42.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.112 0.482 . . . . 74.25 110.528 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 -120.51 122.26 40.24 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.345 -0.613 . . . . 72.209999999999994 109.345 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 511' ' ' HIS . . . . . 0.501 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 12.8 m-70 -109.95 121.64 45.72 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 121.141 -0.223 . . . . 72.200000000000003 110.604 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.621 HD11 ' HD2' ' A' ' 501' ' ' TYR . 67.9 tp -106.93 110.62 22.82 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.45 -0.574 . . . . 74.510000000000005 109.45 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.413 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.1 mp -100.84 119.85 49.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.238 -0.437 . . . . 75.519999999999996 110.145 -178.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.494 ' HB ' ' O ' ' A' ' 471' ' ' VAL . 69.0 mt -106.91 121.27 59.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.395 -0.594 . . . . 74.439999999999998 109.395 174.408 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -64.96 -51.65 60.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.172 -0.467 . . . . 74.030000000000001 110.227 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 516' ' ' GLU . . . . . 0.432 ' O ' ' HE2' ' A' ' 500' ' ' LYS . 42.0 mt-10 -139.39 129.7 25.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.986 -0.552 . . . . 75.439999999999998 110.157 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.408 ' O ' HG13 ' A' ' 467' ' ' VAL . . . -64.04 132.44 50.57 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.966 -0.383 . . . . 71.109999999999999 109.966 175.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 49.7 ttm -128.6 171.85 11.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.926 -0.579 . . . . 60.409999999999997 109.625 -174.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 9.4 mp -54.87 -31.77 60.07 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.188 0.44 . . . . 62.229999999999997 112.188 -178.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -65.33 -21.45 66.7 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.485 0.55 . . . . 75.439999999999998 112.485 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -75.39 -14.56 60.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.888 0.375 . . . . 72.310000000000002 110.938 -178.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.431 ' HA ' ' H ' ' A' ' 540' ' ' VAL . . . -64.4 -20.97 66.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.2 -0.455 . . . . 50.25 109.935 173.349 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 523' ' ' GLY . . . . . 0.437 ' HA3' ' HE3' ' A' ' 488' ' ' LYS . . . -66.06 120.65 16.65 Favored Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 110.825 -0.91 . . . . 51.340000000000003 110.825 173.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -64.09 106.93 1.15 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.089 0.471 . . . . 64.329999999999998 110.956 -172.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 525' ' ' TYR . . . . . 0.416 ' HA ' ' O ' ' A' ' 487' ' ' LEU . 96.9 m-85 -75.09 135.03 41.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.416 -0.811 . . . . 73.120000000000005 111.459 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.648 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -126.07 139.57 53.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.559 -0.746 . . . . 75.150000000000006 109.678 175.495 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 37.5 tp -97.97 107.1 19.51 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.894 -0.409 . . . . 64.109999999999999 109.894 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 53.2 m -91.7 114.01 26.43 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.17 -0.468 . . . . 71.420000000000002 110.368 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 3.2 m -119.2 163.4 17.14 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.872 -0.604 . . . . 64.239999999999995 109.915 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 26.0 t -72.64 -5.29 36.42 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 111.769 0.285 . . . . 64.439999999999998 111.769 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -119.83 -105.7 2.11 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.562 -0.828 . . . . 75.25 111.701 177.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -91.02 124.24 7.47 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.902 -0.879 . . . . 62.32 110.902 174.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -94.13 141.57 28.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.952 0.406 . . . . 70.439999999999998 110.241 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -103.62 125.11 49.93 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.115 -0.493 . . . . 74.120000000000005 110.365 -178.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 5.2 tt -128.34 121.43 29.15 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.25 0.548 . . . . 74.230000000000004 110.294 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -135.0 141.26 46.17 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.458 -0.942 . . . . 74.420000000000002 108.458 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -96.43 109.7 22.19 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.044 0.926 . . . . 75.340000000000003 110.543 -174.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 54.8 tp -95.76 136.75 35.78 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.641 -1.163 . . . . 51.219999999999999 109.733 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 55.8 mt -126.08 118.87 52.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.992 -0.549 . . . . 72.310000000000002 109.649 177.307 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.431 ' H ' ' HA ' ' A' ' 522' ' ' ALA . 40.9 t -114.44 105.41 18.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 109.699 -0.482 . . . . 65.439999999999998 109.699 179.323 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -87.36 139.29 30.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.852 -0.613 . . . . 75.310000000000002 110.864 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 542' ' ' GLU . . . . . 0.41 ' H ' ' CD ' ' A' ' 542' ' ' GLU . 1.0 OUTLIER -86.47 155.99 20.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.456 -0.793 . . . . 63.009999999999998 110.679 -178.65 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 543' ' ' LYS . . . . . 0.401 ' HB3' ' HE3' ' A' ' 543' ' ' LYS . 26.3 mtpp . . . . . 0 C--O 1.248 1.011 0 CA-C-N 115.904 -0.589 . . . . 73.540000000000006 109.673 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 453' ' ' PRO . . . . . 0.463 ' O ' HD22 ' A' ' 455' ' ' LEU . 35.1 Cg_exo . . . . . 0 N--CA 1.466 -0.139 0 N-CA-C 110.931 -0.45 . . . . 73.519999999999996 110.931 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 56.5 t -65.98 113.32 2.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.932 -0.307 . . . . 71.400000000000006 110.341 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 455' ' ' LEU . . . . . 0.463 HD22 ' O ' ' A' ' 453' ' ' PRO . 2.6 mm? -78.62 125.22 29.07 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.113 -0.494 . . . . 70.230000000000004 111.084 -176.601 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 36.5 mm -81.96 106.34 12.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.064 -0.717 . . . . 64.340000000000003 109.064 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 86.1 m -62.02 -39.54 92.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.105 -0.498 . . . . 74.329999999999998 111.491 -175.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 458' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -128.63 121.84 21.36 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.445 -0.343 . . . . 64.140000000000001 110.532 -179.104 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.49 167.88 23.64 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.932 2.422 . . . . 70.400000000000006 112.398 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 460' ' ' LEU . . . . . 0.482 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 97.0 mt -80.89 147.38 30.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 74.439999999999998 110.586 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -55.67 122.25 10.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.451 -0.795 . . . . 63.439999999999998 111.721 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -93.18 -11.09 33.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.238 -0.892 . . . . 63.399999999999999 112.054 -176.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -88.05 157.42 18.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.473 0.654 . . . . 74.109999999999999 111.882 -169.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 9.0 tt -86.84 142.3 28.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.016 -0.993 . . . . 72.030000000000001 110.534 -173.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 27.7 m -130.18 178.17 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 CA-C-N 115.936 -0.575 . . . . 72.5 110.823 -178.038 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 21.0 ptp -127.24 160.28 31.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.965 0.412 . . . . 75.329999999999998 111.531 -178.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.63 146.25 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.188 -0.914 . . . . 62.420000000000002 112.45 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 102.02 -7.79 55.2 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 121.084 -0.579 . . . . 45.130000000000003 114.136 171.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -112.51 167.71 10.23 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 122.268 -0.548 . . . . 64.549999999999997 110.323 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.98 141.34 29.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.976 -0.749 . . . . 65.310000000000002 108.976 176.617 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.731 HG23 ' HB ' ' A' ' 514' ' ' ILE . 6.8 m -127.96 123.38 60.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 121.294 0.569 . . . . 54.009999999999998 110.01 176.613 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -121.93 123.96 42.94 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.303 0.573 . . . . 73.150000000000006 110.577 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -114.06 132.67 55.94 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.234 -0.894 . . . . 75.109999999999999 109.615 -175.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -120.32 116.91 26.47 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.46 -0.496 . . . . 73.120000000000005 110.669 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.666 ' O ' ' HB2' ' A' ' 510' ' ' HIS . 5.9 p -139.26 110.95 7.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.726 -0.67 . . . . 54.409999999999997 109.974 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.602 ' HB3' ' H ' ' A' ' 510' ' ' HIS . 0.6 OUTLIER -128.92 163.27 25.66 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.238 -0.437 . . . . 73.439999999999998 110.343 -178.644 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.513 HG21 ' HB3' ' A' ' 482' ' ' ALA . 17.7 m -113.67 171.91 3.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.25 -0.432 . . . . 72.209999999999994 110.874 -173.317 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 20.2 t -88.79 -22.28 23.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.043 -0.526 . . . . 70.450000000000003 110.854 -177.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -96.75 132.51 42.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.632 -0.507 . . . . 75.239999999999995 109.632 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 480' ' ' GLU . . . . . 0.651 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 11.4 pt-20 -87.47 137.54 32.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.108 0.48 . . . . 74.310000000000002 111.012 -175.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 95.58 -6.97 68.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.831 -0.699 . . . . 55.299999999999997 111.959 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.513 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -77.97 110.71 13.14 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.121 0.486 . . . . 74.299999999999997 110.187 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -92.8 164.88 13.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.822 -0.626 . . . . 62.420000000000002 110.508 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.489 HG12 HG23 ' A' ' 529' ' ' THR . 35.5 m -135.95 154.82 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.208 -0.451 . . . . 71.310000000000002 110.345 -178.15 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -117.42 138.71 51.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.769 -0.456 . . . . 74.5 109.769 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 486' ' ' TRP . . . . . 0.587 ' HB2' HD21 ' A' ' 493' ' ' LEU . 87.6 m95 -99.34 138.12 36.87 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.045 0.45 . . . . 72.0 111.217 -176.059 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 487' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 34.5 tp -121.84 128.99 52.27 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.259 -0.645 . . . . 72.140000000000001 109.259 176.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -112.36 106.68 15.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.004 0.431 . . . . 70.019999999999996 110.909 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.1 t70 53.63 36.82 24.56 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.447 -0.797 . . . . 73.340000000000003 111.625 174.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 94.15 -21.02 44.49 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.771 -0.728 . . . . 62.399999999999999 112.669 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 61.6 t -99.77 133.07 43.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 110.099 -0.334 . . . . 74.319999999999993 110.099 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -78.81 125.61 29.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.868 -0.79 . . . . 63.119999999999997 108.868 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.587 HD21 ' HB2' ' A' ' 486' ' ' TRP . 3.2 pp -68.73 161.82 27.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.382 0.61 . . . . 71.420000000000002 112.098 -170.731 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 6.6 t -107.4 172.88 6.58 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.126 -0.943 . . . . 52.530000000000001 110.903 -172.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -104.64 7.62 35.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.224 0.535 . . . . 75.109999999999999 110.274 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -62.11 -69.44 0.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.876 -0.602 . . . . 71.120000000000005 111.417 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 497' ' ' GLU . . . . . 0.538 ' OE2' ' HB2' ' A' ' 500' ' ' LYS . 25.7 tt0 -106.68 118.89 37.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.116 0.484 . . . . 72.319999999999993 110.477 178.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.605 HG22 ' HB3' ' A' ' 502' ' ' TRP . 3.9 m -111.27 11.69 21.7 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.629 0.728 . . . . 71.430000000000007 109.686 175.131 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 499' ' ' PHE . . . . . 0.502 ' H ' ' HG2' ' A' ' 497' ' ' GLU . 89.3 m-85 -83.81 -25.51 30.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.639 -0.71 . . . . 72.340000000000003 111.249 -176.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 500' ' ' LYS . . . . . 0.538 ' HB2' ' OE2' ' A' ' 497' ' ' GLU . 4.6 ttmp? -69.69 -42.43 74.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.113 0.483 . . . . 72.439999999999998 110.017 177.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.505 ' HB2' HG12 ' A' ' 514' ' ' ILE . 7.5 p90 -159.0 142.2 14.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.499 -0.773 . . . . 63.340000000000003 110.164 -178.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 502' ' ' TRP . . . . . 0.605 ' HB3' HG22 ' A' ' 498' ' ' THR . 0.1 OUTLIER -140.78 145.59 36.55 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.201 -0.454 . . . . 74.329999999999998 110.991 178.478 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 503' ' ' PHE . . . . . 0.472 ' HB3' HD13 ' A' ' 512' ' ' LEU . 31.2 p90 -117.77 151.69 36.8 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.21 -0.45 . . . . 74.25 109.925 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -115.52 135.44 54.09 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.981 -0.554 . . . . 73.140000000000001 109.787 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 1.9 pptp? -104.49 132.71 50.42 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.856 -0.424 . . . . 72.519999999999996 109.856 172.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 506' ' ' ASP . . . . . 0.686 ' HB3' ' HB2' ' A' ' 509' ' ' ARG . 8.0 t70 -143.2 84.38 1.82 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.168 -0.469 . . . . 73.310000000000002 109.865 -177.017 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.31 -97.61 0.34 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.032 -0.604 . . . . 74.150000000000006 111.854 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.651 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 19.1 pt20 -105.55 -7.69 18.46 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.328 0.585 . . . . 73.239999999999995 110.315 176.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.686 ' HB2' ' HB3' ' A' ' 506' ' ' ASP . 58.2 mtt180 -84.66 139.87 31.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.415 -0.811 . . . . 73.409999999999997 110.807 -175.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 510' ' ' HIS . . . . . 0.666 ' HB2' ' O ' ' A' ' 475' ' ' CYS . 95.2 m-70 -141.77 116.99 10.07 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.414 -0.587 . . . . 73.140000000000001 109.414 174.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 19.8 m-70 -125.75 122.88 37.5 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.93 -0.396 . . . . 75.349999999999994 109.93 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 503' ' ' PHE . 54.0 tp -107.39 120.14 41.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.861 0.362 . . . . 54.43 110.513 -176.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 60.5 mt -115.06 114.51 46.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 116.504 -0.316 . . . . 52.450000000000003 110.556 -178.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.731 ' HB ' HG23 ' A' ' 471' ' ' VAL . 58.5 mt -100.59 119.86 49.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.196 0.522 . . . . 71.200000000000003 109.598 176.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -70.75 -37.71 73.44 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.359 -0.837 . . . . 64.450000000000003 111.935 -173.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -138.63 111.07 7.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.598 -0.274 . . . . 74.319999999999993 111.296 -177.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -67.29 122.35 17.69 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.679 -0.489 . . . . 64.430000000000007 109.679 173.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 93.9 mmm -135.04 175.21 9.79 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.886 -0.597 . . . . 74.219999999999999 110.548 -174.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.83 -33.76 74.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.858 0.361 . . . . 72.400000000000006 110.77 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -62.85 -26.56 68.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.224 0.535 . . . . 73.230000000000004 111.071 173.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -83.2 -14.89 52.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.423 -0.808 . . . . 70.319999999999993 110.151 -177.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -76.31 5.61 6.79 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.795 -0.638 . . . . 52.210000000000001 111.202 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -70.64 158.14 53.61 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.908 -0.663 . . . . 64.209999999999994 111.607 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -83.3 114.16 21.21 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 122.048 -0.678 . . . . 72.099999999999994 109.999 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -88.37 132.97 34.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.149 0.5 . . . . 61.539999999999999 111.503 -174.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.615 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -122.69 142.92 50.16 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.607 -0.724 . . . . 72.030000000000001 109.702 175.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.713 ' HB3' ' HB3' ' A' ' 534' ' ' ALA . 10.0 tt -121.13 117.92 28.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.986 0.422 . . . . 44.049999999999997 109.999 -176.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 55.9 m -99.23 124.02 43.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.01 -0.541 . . . . 72.209999999999994 110.482 -179.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.503 ' HB ' ' H ' ' A' ' 532' ' ' GLY . 2.3 m -113.78 166.13 11.86 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.168 -0.308 . . . . 74.439999999999998 110.168 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 9.5 m -54.83 -36.32 64.89 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.807 0.337 . . . . 70.420000000000002 111.83 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -136.43 -6.77 1.79 Allowed Glycine 0 C--O 1.227 -0.304 0 C-N-CA 120.476 -0.869 . . . . 74.329999999999998 112.716 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 532' ' ' GLY . . . . . 0.503 ' H ' ' HB ' ' A' ' 529' ' ' THR . . . -115.34 173.27 14.64 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.828 -0.701 . . . . 52.549999999999997 112.266 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -146.68 137.63 24.08 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.917 -0.401 . . . . 72.439999999999998 109.917 177.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 534' ' ' ALA . . . . . 0.713 ' HB3' ' HB3' ' A' ' 527' ' ' LEU . . . -132.65 148.55 52.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.405 -0.361 . . . . 62.450000000000003 110.501 178.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 7.7 tt -144.62 131.28 20.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.609 -0.886 . . . . 63.520000000000003 108.609 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 536' ' ' ALA . . . . . 0.482 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -135.13 137.44 42.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.157 0.503 . . . . 51.310000000000002 110.757 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -99.68 109.09 21.58 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.994 -0.548 . . . . 75.030000000000001 109.846 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 52.7 tp -104.23 115.87 31.18 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.731 -0.668 . . . . 54.329999999999998 109.792 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.436 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 54.6 mt -105.65 112.37 38.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 109.769 -0.456 . . . . 74.239999999999995 109.769 177.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 36.3 t -102.97 102.37 13.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 116.043 -0.526 . . . . 71.510000000000005 109.75 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -85.36 145.74 27.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.029 -0.532 . . . . 73.420000000000002 111.145 -176.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -81.05 153.77 27.2 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.313 -0.625 . . . . 74.200000000000003 109.313 172.074 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.337 -0.839 . . . . 53.310000000000002 110.085 -178.099 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo . . . . . 0 N--CA 1.463 -0.291 0 CA-C-O 120.881 0.284 . . . . 52.5 111.701 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.69 114.72 3.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.199 -0.455 . . . . 63.420000000000002 110.275 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 93.4 mt -78.98 142.95 36.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.856 -0.611 . . . . 71.219999999999999 110.995 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.414 HD13 HG12 ' A' ' 477' ' ' VAL . 31.0 mm -96.84 119.24 44.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.617 -0.72 . . . . 40.32 109.93 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 31.6 p -92.45 -31.7 15.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.022 0.439 . . . . 74.310000000000002 111.597 -178.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.753 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 18.5 mmt180 -101.18 121.63 51.28 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.284 -0.417 . . . . 74.5 110.638 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -86.78 161.27 9.11 Favored 'Trans proline' 0 N--CA 1.45 -1.049 0 C-N-CA 122.077 1.851 . . . . 64.439999999999998 112.176 175.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -83.3 172.32 12.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.008 -0.542 . . . . 42.340000000000003 110.062 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 461' ' ' GLU . . . . . 0.868 ' HG3' HD13 ' A' ' 538' ' ' LEU . 4.7 pm0 -56.99 118.21 4.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.818 0.818 . . . . 73.140000000000001 112.856 -172.612 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -95.28 -19.1 20.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.48 -0.782 . . . . 73.329999999999998 110.302 172.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -92.16 154.72 18.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 75.230000000000004 111.605 -174.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.705 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 3.2 tt -90.12 134.86 34.01 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.021 -0.733 . . . . 73.030000000000001 109.021 176.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.483 ' N ' HD23 ' A' ' 464' ' ' LEU . 35.8 m -120.8 160.98 21.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.176 0.513 . . . . 73.409999999999997 111.778 -174.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 466' ' ' MET . . . . . 0.441 ' SD ' ' HD3' ' A' ' 543' ' ' LYS . 23.1 ptp -98.85 153.37 18.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 74.109999999999999 110.582 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 467' ' ' VAL . . . . . 0.46 ' CG1' ' HA ' ' A' ' 542' ' ' GLU . 14.3 p -69.01 145.21 13.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 72.25 111.246 177.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 100.5 -24.74 30.92 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.778 -0.725 . . . . 44.210000000000001 113.7 172.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -85.81 162.0 18.86 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 117.191 0.496 . . . . 71.010000000000005 110.916 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -86.27 116.8 24.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.962 -0.563 . . . . 70.430000000000007 109.778 176.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 22.0 t -117.23 126.74 74.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 110.037 -0.357 . . . . 52.549999999999997 110.037 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.505 ' HG2' HG23 ' A' ' 513' ' ' ILE . 41.2 mt-10 -109.07 123.47 49.22 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.447 -0.342 . . . . 74.030000000000001 110.201 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.591 ' CE1' ' HB3' ' A' ' 461' ' ' GLU . 25.3 m-85 -106.85 109.08 20.89 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.415 -0.587 . . . . 71.349999999999994 109.415 177.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 474' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' A' ' 458' ' ' ARG . 29.5 mt-10 -106.58 116.73 32.44 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.701 -0.481 . . . . 64.230000000000004 109.701 -178.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.753 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 36.8 t -135.69 111.81 9.65 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.227 0.537 . . . . 73.519999999999996 110.07 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.627 ' HB3' ' H ' ' A' ' 510' ' ' HIS . 7.3 pt-20 -131.05 167.67 18.69 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.776 -0.647 . . . . 72.530000000000001 109.897 -176.575 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.663 HG21 ' HB3' ' A' ' 482' ' ' ALA . 20.9 m -115.06 166.94 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.932 0.396 . . . . 75.129999999999995 111.59 -172.433 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 41.2 t -86.34 -11.08 53.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.73 -0.668 . . . . 73.109999999999999 111.695 -176.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -116.22 139.72 50.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.903 0.382 . . . . 71.010000000000005 111.208 -175.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 480' ' ' GLU . . . . . 0.637 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 7.7 tp10 -75.49 146.83 40.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.65 -0.705 . . . . 72.099999999999994 110.79 -177.37 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 82.43 -8.76 60.58 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 116.018 -0.537 . . . . 73.040000000000006 112.977 177.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.663 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -74.72 116.26 15.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.418 0.627 . . . . 71.200000000000003 111.484 -176.244 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -82.31 156.05 24.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.115 -0.948 . . . . 72.120000000000005 110.327 178.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 26.8 m -129.27 154.36 40.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.322 -0.399 . . . . 73.409999999999997 110.726 -178.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 485' ' ' LYS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 57.3 tttp -118.49 134.93 54.69 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.871 -0.604 . . . . 63.43 110.076 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -98.23 122.06 40.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.069 0.461 . . . . 64.319999999999993 110.582 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 24.4 tp -120.12 125.35 48.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.654 -0.703 . . . . 64.519999999999996 109.53 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.552 ' HD2' HD21 ' A' ' 493' ' ' LEU . 26.1 tttp -101.65 103.65 14.46 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.762 -0.458 . . . . 64.230000000000004 109.762 -177.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.6 t0 45.81 38.23 4.16 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.781 0.832 . . . . 73.329999999999998 112.518 -179.183 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 93.02 -4.75 75.17 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.542 -0.837 . . . . 54.229999999999997 112.711 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 54.3 t -99.85 127.32 52.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.947 -0.39 . . . . 54.140000000000001 109.947 176.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -72.95 124.56 25.69 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.066 -0.515 . . . . 62.210000000000001 110.598 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.552 HD21 ' HD2' ' A' ' 488' ' ' LYS . 86.0 mt -76.49 148.54 37.11 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.135 -0.484 . . . . 63.009999999999998 110.787 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 7.8 t -93.48 165.47 12.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.901 -0.59 . . . . 73.510000000000005 110.771 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -65.61 -29.07 69.61 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.061 0.458 . . . . 73.510000000000005 110.677 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -108.77 80.77 1.37 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.3 0.572 . . . . 74.239999999999995 110.506 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -96.52 161.32 13.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.354 -0.839 . . . . 73.519999999999996 109.888 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 11.2 t -63.29 151.86 39.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.058 0.456 . . . . 62.299999999999997 110.962 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -85.23 16.97 3.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.098 -0.501 . . . . 72.109999999999999 111.12 -176.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 500' ' ' LYS . . . . . 0.7 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 33.3 tttp -71.66 -28.06 63.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.482 -0.562 . . . . 74.340000000000003 109.482 177.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.554 ' HB3' HG23 ' A' ' 514' ' ' ILE . 2.2 p90 -142.82 135.01 27.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.661 -0.7 . . . . 73.310000000000002 110.101 173.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 502' ' ' TRP . . . . . 0.488 ' CZ3' ' HE3' ' A' ' 504' ' ' LYS . 11.4 p-90 -139.17 166.51 24.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.513 -0.767 . . . . 75.019999999999996 109.705 -172.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -133.58 157.46 45.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.438 0.637 . . . . 64.25 112.403 -175.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.488 ' HE3' ' CZ3' ' A' ' 502' ' ' TRP . 99.7 mttt -118.21 150.73 38.93 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.549 -1.205 . . . . 73.329999999999998 108.913 174.564 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.4 pptp? -137.94 129.87 28.59 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.348 0.594 . . . . 72.340000000000003 111.208 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 506' ' ' ASP . . . . . 0.652 ' HB2' ' HB2' ' A' ' 509' ' ' ARG . 26.9 m-20 -119.56 79.5 1.44 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.58 -0.896 . . . . 50.310000000000002 108.58 173.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 60.33 -104.44 0.62 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.92 -0.657 . . . . 74.530000000000001 112.402 -175.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.637 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 20.7 pt20 -80.39 -16.38 54.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.995 0.426 . . . . 75.120000000000005 110.734 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.652 ' HB2' ' HB2' ' A' ' 506' ' ' ASP . 84.8 mtt180 -84.71 132.02 34.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.126 -0.488 . . . . 63.539999999999999 110.12 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 510' ' ' HIS . . . . . 0.627 ' H ' ' HB3' ' A' ' 476' ' ' GLU . 77.9 m-70 -136.14 117.11 14.25 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.38 -0.6 . . . . 72.349999999999994 109.38 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -125.63 121.71 34.32 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 121.034 -0.266 . . . . 62.409999999999997 110.498 -175.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 512' ' ' LEU . . . . . 0.409 ' HB3' ' O ' ' A' ' 473' ' ' PHE . 37.7 tp -103.61 133.11 49.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.717 0.294 . . . . 61.329999999999998 110.435 -178.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.505 HG23 ' HG2' ' A' ' 472' ' ' GLU . 4.7 mp -121.19 116.85 50.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 110.083 -0.34 . . . . 60.119999999999997 110.083 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.554 HG23 ' HB3' ' A' ' 501' ' ' TYR . 46.9 mt -97.49 120.56 46.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.399 -0.593 . . . . 75.409999999999997 109.399 175.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -69.06 -41.06 78.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.006 0.432 . . . . 75.150000000000006 110.483 -177.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 516' ' ' GLU . . . . . 0.7 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 34.2 mt-10 -137.47 107.95 6.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.94 -0.573 . . . . 73.420000000000002 110.407 -178.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -65.26 122.59 17.46 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.264 -0.643 . . . . 52.229999999999997 109.264 174.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 518' ' ' MET . . . . . 0.497 ' HG3' ' HG2' ' A' ' 520' ' ' GLU . 11.9 tpt -125.83 157.1 38.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.667 0.27 . . . . 75.430000000000007 110.858 -172.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.93 -38.14 84.76 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.231 -0.441 . . . . 73.230000000000004 111.397 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 520' ' ' GLU . . . . . 0.497 ' HG2' ' HG3' ' A' ' 518' ' ' MET . 10.4 pt-20 -70.15 -22.35 62.99 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.222 0.534 . . . . 75.299999999999997 110.832 178.031 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -88.09 -13.29 41.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.707 -0.679 . . . . 73.430000000000007 110.392 -176.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.524 ' HB2' ' HB ' ' A' ' 540' ' ' VAL . . . -63.0 6.19 0.11 Allowed 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.723 1.009 . . . . 74.239999999999995 113.723 -174.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -59.67 137.03 50.01 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.273 -0.731 . . . . 72.150000000000006 111.273 175.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -60.94 126.48 27.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.356 -0.238 . . . . 52.25 110.356 -175.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -84.95 131.15 34.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.83 0.824 . . . . 73.25 112.19 -174.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.1 135.79 48.62 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.765 -1.107 . . . . 52.329999999999998 109.837 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 9.9 tt -122.32 122.99 40.36 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.68 -0.489 . . . . 61.310000000000002 109.68 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 528' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 57.6 m -103.61 124.55 49.02 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.983 -0.553 . . . . 75.519999999999996 110.598 -177.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.478 HG21 HG11 ' A' ' 477' ' ' VAL . 14.3 m -117.56 166.59 12.2 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.344 -0.613 . . . . 73.129999999999995 109.344 176.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 530' ' ' SER . . . . . 0.429 ' N ' HG22 ' A' ' 529' ' ' THR . 22.9 t -66.68 -11.24 53.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.82 0.343 . . . . 72.140000000000001 110.699 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -99.52 -83.6 1.74 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.0 -0.619 . . . . 71.439999999999998 112.05 177.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -114.02 166.96 12.2 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.7 -0.762 . . . . 63.229999999999997 112.24 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -109.92 122.71 48.18 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.802 -0.444 . . . . 62.439999999999998 109.802 177.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -103.2 135.12 45.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.46 -0.336 . . . . 44.240000000000002 110.431 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 8.3 tt -146.05 136.69 24.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.892 -0.41 . . . . 63.229999999999997 109.892 -178.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -143.5 155.27 44.29 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.278 -0.419 . . . . 72.439999999999998 109.945 178.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -96.54 112.06 23.95 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.4 0.619 . . . . 64.430000000000007 111.225 -177.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.868 HD13 ' HG3' ' A' ' 461' ' ' GLU . 62.8 tp -94.52 136.45 34.81 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.668 -0.697 . . . . 64.200000000000003 110.115 177.132 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.705 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 65.3 mt -133.15 134.03 57.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.848 -0.797 . . . . 75.010000000000005 108.848 175.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.524 ' HB ' ' HB2' ' A' ' 522' ' ' ALA . 98.4 t -122.84 116.28 48.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 110.021 -0.362 . . . . 70.209999999999994 110.021 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 541' ' ' GLN . . . . . 0.635 ' HG3' HD21 ' A' ' 464' ' ' LEU . 50.4 mt-30 -94.34 140.58 29.62 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.25 -0.432 . . . . 74.200000000000003 110.758 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 542' ' ' GLU . . . . . 0.46 ' HA ' ' CG1' ' A' ' 467' ' ' VAL . 41.9 tt0 -75.0 141.26 43.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.534 -0.757 . . . . 64.209999999999994 109.541 175.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 543' ' ' LYS . . . . . 0.441 ' HD3' ' SD ' ' A' ' 466' ' ' MET . 54.4 mtmt . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.13 -0.938 . . . . 74.219999999999999 109.512 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.455 -0.754 0 CA-C-O 120.857 0.274 . . . . 73.230000000000004 111.424 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 454' ' ' VAL . . . . . 0.438 HG12 ' HB ' ' A' ' 477' ' ' VAL . 19.6 t -74.9 111.26 10.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.59 -0.522 . . . . 72.019999999999996 109.59 178.064 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 90.6 mt -97.6 164.06 12.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.924 -0.58 . . . . 73.219999999999999 110.901 -175.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 456' ' ' ILE . . . . . 0.473 HD13 HG12 ' A' ' 477' ' ' VAL . 48.4 mm -96.87 115.06 35.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.838 -0.619 . . . . 63.450000000000003 110.193 -178.44 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 33.7 m -85.69 -35.61 20.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.145 0.498 . . . . 65.409999999999997 110.823 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 458' ' ' ARG . . . . . 0.839 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 5.7 mmp_? -108.52 108.14 60.71 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.094 -0.503 . . . . 71.140000000000001 110.362 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_exo -70.78 155.63 62.21 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.405 2.07 . . . . 72.200000000000003 111.436 176.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.11 162.7 23.59 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.774 -0.454 . . . . 74.200000000000003 109.774 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -69.91 121.04 16.56 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.487 0.661 . . . . 61.399999999999999 111.444 -173.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -92.22 -11.65 34.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.993 -1.003 . . . . 73.510000000000005 111.711 -176.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -87.56 156.01 19.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.127 0.489 . . . . 71.340000000000003 110.925 -170.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.659 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 6.0 tt -88.55 136.61 32.9 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.363 -0.835 . . . . 74.150000000000006 109.679 -171.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 465' ' ' VAL . . . . . 0.49 ' N ' HD23 ' A' ' 464' ' ' LEU . 30.6 m -120.97 172.25 8.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.269 0.557 . . . . 70.239999999999995 111.655 -173.142 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 466' ' ' MET . . . . . 0.534 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 66.5 mtt -116.62 163.52 15.98 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.795 -0.639 . . . . 64.310000000000002 109.964 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 467' ' ' VAL . . . . . 0.5 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 48.6 t -65.04 131.02 30.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.338 -0.392 . . . . 72.120000000000005 111.185 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.14 -14.32 58.43 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.818 -0.706 . . . . 74.510000000000005 114.602 171.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 466' ' ' MET . 16.5 pt20 -83.17 149.42 26.86 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.923 0.862 . . . . 64.140000000000001 110.637 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 44.8 ttt180 -73.6 116.1 13.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.524 -0.762 . . . . 71.209999999999994 110.567 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 95.0 t -120.86 123.38 70.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.792 -0.64 . . . . 71.430000000000007 109.859 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -133.92 140.79 47.02 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.185 0.517 . . . . 74.519999999999996 110.172 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.544 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 90.5 m-85 -105.99 124.8 50.15 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.854 -0.612 . . . . 71.519999999999996 110.786 -175.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -97.63 117.73 32.57 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.969 -1.123 . . . . 74.129999999999995 107.969 176.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 475' ' ' CYS . . . . . 0.839 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 6.4 p -140.23 119.04 12.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.184 0.516 . . . . 73.099999999999994 111.699 -175.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.599 ' HG2' ' CG ' ' A' ' 458' ' ' ARG . 10.1 pt-20 -131.05 148.81 52.79 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.005 -0.739 . . . . 73.239999999999995 109.005 175.26 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 477' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 482' ' ' ALA . 18.3 m -111.19 164.38 7.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 116.238 -0.437 . . . . 73.129999999999995 110.859 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 53.5 p -65.67 -25.89 67.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.032 -0.531 . . . . 71.109999999999999 112.403 -174.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -106.87 133.7 51.13 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.912 -0.315 . . . . 70.340000000000003 110.786 -174.158 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 480' ' ' GLU . . . . . 0.665 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 10.0 tp10 -73.36 147.4 44.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.086 -0.506 . . . . 74.430000000000007 110.673 -178.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 61.27 34.45 88.2 Favored Glycine 0 N--CA 1.453 -0.221 0 CA-C-N 115.898 -0.592 . . . . 53.520000000000003 112.82 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.49 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -95.19 154.45 17.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.006 0.432 . . . . 62.310000000000002 111.062 -178.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -100.77 133.11 45.72 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.75 -0.659 . . . . 73.019999999999996 110.647 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 484' ' ' VAL . . . . . 0.519 ' HB ' HD21 ' A' ' 527' ' ' LEU . 32.5 m -124.15 144.24 34.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.931 -0.577 . . . . 70.329999999999998 109.547 175.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -126.96 141.04 51.9 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.751 0.31 . . . . 65.140000000000001 110.292 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -98.3 137.35 37.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.086 -0.507 . . . . 73.439999999999998 111.074 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 55.6 tp -134.21 118.78 18.0 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.747 -0.835 . . . . 74.349999999999994 108.747 173.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 488' ' ' LYS . . . . . 0.455 ' HD3' ' C ' ' A' ' 488' ' ' LYS . 14.1 tmtt? -109.52 106.2 15.83 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.703 -0.399 . . . . 64.219999999999999 110.518 -176.293 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 2.5 t70 48.66 38.74 12.08 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.333 -0.849 . . . . 72.400000000000006 112.015 173.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.62 -16.01 60.26 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.79 -0.719 . . . . 73.010000000000005 113.001 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 47.4 t -104.72 122.23 57.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.741 0.305 . . . . 72.109999999999999 110.427 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -81.46 133.94 35.47 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.765 -0.457 . . . . 62.020000000000003 109.765 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 69.4 mt -74.99 152.89 38.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.104 -0.498 . . . . 65.329999999999998 111.114 -175.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 494' ' ' THR . . . . . 0.685 HG22 ' H ' ' A' ' 496' ' ' GLU . 4.8 m -91.2 141.51 28.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.029 -0.532 . . . . 63.310000000000002 110.937 -175.432 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -83.13 -6.2 59.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.23 0.538 . . . . 74.230000000000004 110.539 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 496' ' ' GLU . . . . . 0.685 ' H ' HG22 ' A' ' 494' ' ' THR . 7.6 pt-20 -130.35 34.72 4.15 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.554 -0.748 . . . . 73.200000000000003 109.763 178.338 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 497' ' ' GLU . . . . . 0.569 ' HB2' ' HB ' ' A' ' 494' ' ' THR . 7.1 tp10 -71.93 170.71 13.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.315 -0.857 . . . . 71.420000000000002 110.782 -176.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 498' ' ' THR . . . . . 0.473 HG23 ' H ' ' A' ' 500' ' ' LYS . 8.9 t -68.58 -176.7 0.83 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.119 -0.491 . . . . 74.219999999999999 110.837 175.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -78.99 17.1 0.79 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.456 -0.338 . . . . 71.120000000000005 111.853 -174.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 500' ' ' LYS . . . . . 0.473 ' H ' HG23 ' A' ' 498' ' ' THR . 21.6 tptm -61.87 -45.96 91.48 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.908 -0.775 . . . . 74.439999999999998 108.908 176.494 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 501' ' ' TYR . . . . . 0.558 ' HB3' HG12 ' A' ' 514' ' ' ILE . 10.1 p90 -143.04 143.39 31.86 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.054 -0.976 . . . . 73.239999999999995 109.52 176.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 35.9 p-90 -135.91 145.34 46.18 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.865 -0.42 . . . . 71.519999999999996 109.865 176.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 503' ' ' PHE . . . . . 0.478 ' HA ' ' O ' ' A' ' 511' ' ' HIS . 44.6 p90 -114.86 140.9 48.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.592 0.711 . . . . 64.129999999999995 111.818 -175.435 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 504' ' ' LYS . . . . . 0.463 ' HB3' ' HB2' ' A' ' 511' ' ' HIS . 24.1 tptm -116.31 114.18 23.99 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.802 -1.09 . . . . 74.310000000000002 109.137 176.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.482 ' HD3' ' O ' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -112.37 138.37 49.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.06 0.457 . . . . 72.510000000000005 112.192 -176.169 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -149.59 85.41 1.44 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.836 -0.62 . . . . 62.149999999999999 109.855 170.168 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 69.5 -116.68 7.18 Favored Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 115.614 -0.721 . . . . 61.25 112.777 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 508' ' ' GLN . . . . . 0.665 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 4.1 pt20 -76.98 -25.95 53.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.708 0.29 . . . . 74.129999999999995 111.508 -177.772 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 509' ' ' ARG . 3.9 ptt180 -99.12 127.0 44.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.374 0.606 . . . . 71.140000000000001 111.448 -174.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -129.39 155.96 44.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.477 -0.783 . . . . 70.439999999999998 109.705 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 511' ' ' HIS . . . . . 0.478 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 80.4 m-70 -138.9 124.58 19.62 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.897 -0.408 . . . . 73.230000000000004 109.897 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 56.9 tp -111.46 106.09 14.89 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.929 -0.397 . . . . 62.420000000000002 109.929 176.462 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 513' ' ' ILE . . . . . 0.407 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.5 mp -103.25 118.41 50.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.06 0.457 . . . . 71.310000000000002 111.018 -176.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 514' ' ' ILE . . . . . 0.558 HG12 ' HB3' ' A' ' 501' ' ' TYR . 62.2 mt -101.9 121.76 53.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.145 -0.687 . . . . 74.25 109.145 174.255 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -64.14 -51.41 64.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.267 -0.424 . . . . 54.350000000000001 111.396 -174.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -133.01 114.87 14.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.342 -0.39 . . . . 73.200000000000003 110.151 175.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -62.69 127.53 31.7 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.695 -0.483 . . . . 75.120000000000005 109.695 173.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 28.6 ttm -132.58 173.68 11.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.976 -0.379 . . . . 74.310000000000002 109.976 -174.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.428 HD22 ' H ' ' A' ' 519' ' ' LEU . 3.4 mm? -53.43 -36.63 61.76 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.606 0.595 . . . . 74.010000000000005 112.606 -172.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 520' ' ' GLU . . . . . 0.486 ' H ' ' CD ' ' A' ' 520' ' ' GLU . 1.8 mp0 -58.92 -35.02 72.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.948 0.404 . . . . 74.140000000000001 110.895 -178.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -74.43 -13.52 60.72 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.995 -0.548 . . . . 73.430000000000007 112.223 -169.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 522' ' ' ALA . . . . . 0.588 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -63.78 7.33 0.12 Allowed 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.911 1.078 . . . . 72.329999999999998 113.911 -175.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -86.63 169.3 40.82 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.987 -0.625 . . . . 72.140000000000001 112.443 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -73.97 119.84 18.74 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 122.717 -0.284 . . . . 74.510000000000005 110.804 -178.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -86.43 135.0 33.66 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.765 0.317 . . . . 72.200000000000003 110.804 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.4 134.63 47.28 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.062 0.458 . . . . 44.530000000000001 110.475 175.011 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 527' ' ' LEU . . . . . 0.519 HD21 ' HB ' ' A' ' 484' ' ' VAL . 7.5 tt -118.04 111.85 19.46 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.053 -0.721 . . . . 71.430000000000007 109.053 177.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 43.9 t -99.24 128.1 45.32 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.926 0.393 . . . . 62.409999999999997 110.593 -177.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 529' ' ' THR . . . . . 0.529 HG22 ' H ' ' A' ' 530' ' ' SER . 1.8 m -117.88 175.47 5.65 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.892 -0.594 . . . . 75.329999999999998 109.45 176.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 530' ' ' SER . . . . . 0.529 ' H ' HG22 ' A' ' 529' ' ' THR . 9.1 m -58.52 -24.36 60.38 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.014 0.375 . . . . 42.119999999999997 112.014 178.163 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -112.28 -88.38 1.76 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.637 -0.792 . . . . 73.349999999999994 112.21 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -94.18 -172.25 38.58 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.819 -0.705 . . . . 43.219999999999999 112.016 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -145.49 147.55 32.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.005 0.431 . . . . 74.019999999999996 110.725 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 534' ' ' ALA . . . . . 0.433 ' HB2' HG21 ' A' ' 456' ' ' ILE . . . -105.75 118.71 37.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.007 -0.542 . . . . 75.329999999999998 110.115 178.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 7.5 tt -114.99 124.72 52.4 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.441 -0.577 . . . . 74.230000000000004 109.441 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -148.36 149.11 31.2 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.985 -0.552 . . . . 61.43 109.809 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -116.77 112.92 21.83 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.372 0.606 . . . . 72.230000000000004 111.052 -177.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.588 ' O ' ' HA ' ' A' ' 522' ' ' ALA . 31.3 tp -96.92 111.5 23.68 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.298 -0.864 . . . . 73.150000000000006 109.462 -179.084 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 539' ' ' ILE . . . . . 0.659 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 63.3 mt -97.47 129.11 48.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 110.129 -0.323 . . . . 63.340000000000003 110.129 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 34.7 t -111.54 116.47 52.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 61.420000000000002 110.601 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 541' ' ' GLN . . . . . 0.565 ' HG3' HD21 ' A' ' 464' ' ' LEU . 98.4 mt-30 -99.61 155.44 17.6 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.085 0.469 . . . . 75.340000000000003 111.173 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -80.56 149.75 29.82 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.615 -0.721 . . . . 74.219999999999999 110.654 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.723 -0.656 . . . . 73.420000000000002 110.157 -179.756 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.651 0 N-CA-C 111.501 -0.64 . . . . 62.409999999999997 111.501 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 2.7 p -74.87 137.21 41.62 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.861 0.363 . . . . 75.340000000000003 110.058 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 17.4 p-80 -89.45 59.44 4.8 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.373 0.606 . . . . 62.420000000000002 110.642 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 24.5 mmt -100.41 106.54 43.19 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.515 -0.766 . . . . 73.230000000000004 109.539 177.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -71.06 140.1 37.12 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.728 2.285 . . . . 43.439999999999998 111.537 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 48.2 t -66.34 115.83 4.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.623 -0.51 . . . . 72.430000000000007 109.623 176.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -78.59 143.57 36.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.172 -0.467 . . . . 34.119999999999997 110.884 -174.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.492 HG21 ' HB2' ' A' ' 534' ' ' ALA . 37.8 mm -95.49 110.77 24.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.356 -0.609 . . . . 63.299999999999997 109.356 175.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 457' ' ' THR . . . . . 0.437 ' HB ' ' HG3' ' A' ' 476' ' ' GLU . 16.5 m -67.99 -40.91 82.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.019 0.438 . . . . 74.129999999999995 111.318 -175.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.716 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 19.5 mmt85 -116.67 120.39 34.43 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.152 -0.476 . . . . 62.119999999999997 110.472 -176.448 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -76.12 165.53 29.48 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 121.935 1.757 . . . . 62.32 110.45 170.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 3.7 mm? -80.43 149.03 30.29 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.647 -0.421 . . . . 65.140000000000001 109.98 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 23.5 mp0 -52.62 119.38 4.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.267 -0.879 . . . . 63.439999999999998 111.999 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -92.01 -11.24 36.53 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.819 -1.082 . . . . 72.239999999999995 112.154 -176.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -88.69 155.12 19.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.166 0.508 . . . . 62.399999999999999 111.139 -172.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 9.4 tt -87.81 136.14 33.08 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.624 -0.716 . . . . 73.439999999999998 109.751 -174.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 35.7 m -121.44 175.65 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.987 -0.552 . . . . 75.340000000000003 110.937 -176.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 466' ' ' MET . . . . . 0.448 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 25.2 ptt? -120.85 152.25 38.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.199 -0.455 . . . . 72.329999999999998 111.077 -176.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 467' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 69.3 t -61.55 139.33 20.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.463 -0.79 . . . . 73.230000000000004 111.244 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.35 -18.34 54.01 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.76 -0.733 . . . . 61.229999999999997 114.105 173.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.448 ' HG2' ' O ' ' A' ' 466' ' ' MET . 9.7 pt20 -94.33 155.47 16.98 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 117.836 0.818 . . . . 75.120000000000005 110.953 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 470' ' ' ARG . . . . . 0.522 ' HG3' ' HA ' ' A' ' 515' ' ' ASN . 42.6 ttm180 -88.02 116.0 25.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.787 -0.642 . . . . 73.230000000000004 109.832 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.403 HG22 HE21 ' A' ' 469' ' ' GLN . 10.4 t -112.78 127.6 69.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.987 0.422 . . . . 65.519999999999996 110.877 -175.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -104.59 123.63 47.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.774 -0.648 . . . . 73.120000000000005 110.048 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.589 ' HE2' HD12 ' A' ' 514' ' ' ILE . 67.5 m-85 -107.39 134.34 50.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.209 -0.45 . . . . 72.430000000000007 109.941 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -122.96 118.43 27.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.03 0.443 . . . . 73.019999999999996 111.37 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 23.0 t -143.08 113.56 7.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.743 -0.662 . . . . 74.319999999999993 109.539 176.515 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.688 ' HB2' ' HA ' ' A' ' 509' ' ' ARG . 13.0 pt-20 -133.51 166.42 22.61 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.291 -0.413 . . . . 75.150000000000006 110.841 -177.01 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.545 HG21 ' HB3' ' A' ' 482' ' ' ALA . 6.7 m -101.09 159.56 3.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.757 -0.656 . . . . 72.099999999999994 110.505 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 22.2 t -80.79 -2.28 46.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.151 -0.477 . . . . 73.340000000000003 111.227 -176.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -134.17 132.8 40.23 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.691 -0.485 . . . . 63.109999999999999 109.691 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -78.94 153.02 30.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.179 0.514 . . . . 73.439999999999998 112.007 -173.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 95.62 -16.85 60.42 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.52 -0.763 . . . . 52.119999999999997 112.359 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.545 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -82.77 132.84 35.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.199 0.523 . . . . 72.430000000000007 111.521 -177.165 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -105.15 165.13 11.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.507 -0.769 . . . . 65.310000000000002 110.189 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.56 HG21 HD11 ' A' ' 527' ' ' LEU . 27.3 m -137.0 173.22 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.39 -0.368 . . . . 71.239999999999995 110.997 -174.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 485' ' ' LYS . . . . . 0.402 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 40.6 ttmt -117.44 140.32 49.74 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.08 -0.509 . . . . 60.130000000000003 109.649 174.145 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -98.71 124.05 43.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.152 0.501 . . . . 75.409999999999997 110.445 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 487' ' ' LEU . . . . . 0.406 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 53.2 tp -115.68 119.21 35.33 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.032 -0.729 . . . . 75.319999999999993 109.032 177.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.42 ' HE2' ' HA3' ' A' ' 523' ' ' GLY . 14.0 tmtt? -121.17 113.05 19.44 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.348 -0.387 . . . . 54.109999999999999 110.778 -175.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 489' ' ' ASP . . . . . 0.467 ' HB2' ' HA3' ' A' ' 523' ' ' GLY . 35.1 t0 55.22 37.92 29.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.483 -0.78 . . . . 70.409999999999997 111.43 173.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 85.03 -4.13 86.02 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.731 -0.747 . . . . 61.240000000000002 112.743 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 44.3 t -103.63 131.86 51.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 120.782 0.325 . . . . 71.329999999999998 110.387 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -83.29 113.96 21.06 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.669 -0.493 . . . . 74.239999999999995 109.669 177.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 92.9 mt -69.32 159.88 32.31 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 111.263 -176.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 494' ' ' THR . . . . . 0.669 HG23 ' HG2' ' A' ' 496' ' ' GLU . 7.5 t -89.54 155.14 19.47 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.771 -0.649 . . . . 75.120000000000005 110.175 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.5 ttt-85 -79.25 77.04 5.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.724 0.297 . . . . 63.530000000000001 110.547 -177.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 496' ' ' GLU . . . . . 0.669 ' HG2' HG23 ' A' ' 494' ' ' THR . 8.4 pt-20 -176.46 147.25 0.66 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.891 -0.595 . . . . 64.230000000000004 109.749 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 497' ' ' GLU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 502' ' ' TRP . 1.0 OUTLIER -104.52 171.32 7.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.966 0.412 . . . . 72.019999999999996 110.398 177.386 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.459 HG23 ' H ' ' A' ' 500' ' ' LYS . 7.8 t -149.04 -178.16 6.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.457 -0.572 . . . . 71.209999999999994 109.457 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -77.88 -3.84 43.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.793 0.33 . . . . 73.420000000000002 111.346 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' LYS . . . . . 0.459 ' H ' HG23 ' A' ' 498' ' ' THR . 64.2 tttp -82.8 -48.62 10.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.352 0.596 . . . . 64.099999999999994 109.535 174.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.615 ' HD2' HD11 ' A' ' 512' ' ' LEU . 19.7 p90 -151.71 141.66 22.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.364 -0.835 . . . . 75.209999999999994 109.371 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 502' ' ' TRP . . . . . 0.529 ' HZ3' ' HB2' ' A' ' 504' ' ' LYS . 55.0 p-90 -140.84 150.51 43.37 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.863 0.363 . . . . 72.519999999999996 110.602 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 503' ' ' PHE . . . . . 0.596 ' HA ' ' O ' ' A' ' 511' ' ' HIS . 41.1 p90 -124.76 139.67 53.64 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.14 -0.482 . . . . 70.230000000000004 110.147 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.529 ' HB2' ' HZ3' ' A' ' 502' ' ' TRP . 61.2 tttm -116.44 145.24 43.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.02 0.438 . . . . 63.509999999999998 110.688 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -107.0 141.78 37.66 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.52 -0.764 . . . . 72.25 109.911 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 506' ' ' ASP . . . . . 0.519 ' HB3' ' CG ' ' A' ' 509' ' ' ARG . 38.6 t70 -149.94 87.14 1.46 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.863 -0.421 . . . . 63.329999999999998 109.863 170.41 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.45 -87.96 0.2 Allowed Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.769 -0.65 . . . . 73.040000000000006 112.675 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -107.52 -27.23 10.52 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.09 0.471 . . . . 74.209999999999994 110.924 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.688 ' HA ' ' HB2' ' A' ' 476' ' ' GLU . 6.7 ptp180 -87.99 143.2 27.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.356 0.598 . . . . 72.510000000000005 111.684 -170.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -135.12 126.9 29.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.354 -0.839 . . . . 73.430000000000007 109.108 179.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 511' ' ' HIS . . . . . 0.596 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 25.8 m-70 -121.2 126.79 50.53 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.949 -0.389 . . . . 74.430000000000007 109.949 -177.281 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.615 HD11 ' HD2' ' A' ' 501' ' ' TYR . 62.8 tp -110.66 108.06 17.84 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.806 -0.442 . . . . 63.43 109.806 178.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.413 HD12 ' N ' ' A' ' 513' ' ' ILE . 3.7 mp -105.14 123.83 59.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 120.852 0.358 . . . . 74.409999999999997 110.648 -176.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.589 HD12 ' HE2' ' A' ' 473' ' ' PHE . 45.1 mt -105.53 122.15 58.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 64.310000000000002 109.522 175.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 515' ' ' ASN . . . . . 0.522 ' HA ' ' HG3' ' A' ' 470' ' ' ARG . 43.1 m-80 -66.13 -42.01 89.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.922 -0.581 . . . . 74.109999999999999 111.976 -172.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -140.94 116.02 9.86 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.352 -0.24 . . . . 74.540000000000006 110.352 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.417 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -62.6 123.46 18.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.924 -0.398 . . . . 63.119999999999997 109.924 175.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 45.0 tpp -132.65 171.94 13.19 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.697 -0.483 . . . . 75.420000000000002 109.697 -177.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -56.46 -32.28 64.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.571 0.224 . . . . 73.540000000000006 111.004 177.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -59.25 -37.25 77.11 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.402 0.62 . . . . 72.25 110.525 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -86.73 -13.22 45.96 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.119 -0.946 . . . . 44.140000000000001 110.894 -173.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.464 ' HB2' ' HB ' ' A' ' 540' ' ' VAL . . . -66.91 7.62 0.36 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.222 0.823 . . . . 53.240000000000002 113.222 -176.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 523' ' ' GLY . . . . . 0.467 ' HA3' ' HB2' ' A' ' 489' ' ' ASP . . . -79.23 165.96 50.99 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.701 -0.761 . . . . 73.040000000000006 112.309 178.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 57.1 m170 -71.07 151.39 44.57 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 122.76 -0.259 . . . . 71.040000000000006 110.625 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -124.83 124.86 42.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.19 0.519 . . . . 75.209999999999994 111.496 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.406 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -128.77 135.44 49.18 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.919 -0.582 . . . . 42.5 110.348 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.613 HD13 ' SG ' ' A' ' 475' ' ' CYS . 2.1 tt -107.95 107.83 18.71 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.999 -0.546 . . . . 73.120000000000005 109.909 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 528' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 70.2 m -88.8 114.85 25.86 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.073 -0.512 . . . . 74.510000000000005 111.676 -174.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.545 ' HB ' ' O ' ' A' ' 532' ' ' GLY . 9.3 m -119.19 158.16 26.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.681 -0.691 . . . . 73.25 109.669 173.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 12.5 m -68.26 -26.65 65.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.804 0.335 . . . . 74.219999999999999 111.387 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -87.89 -90.76 1.07 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.824 -0.703 . . . . 70.319999999999993 111.637 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 532' ' ' GLY . . . . . 0.545 ' O ' ' HB ' ' A' ' 529' ' ' THR . . . -97.34 176.05 31.15 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.639 -0.791 . . . . 63.140000000000001 111.272 174.468 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -141.07 126.95 19.23 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.874 -0.417 . . . . 64.200000000000003 109.874 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 534' ' ' ALA . . . . . 0.492 ' HB2' HG21 ' A' ' 456' ' ' ILE . . . -96.93 117.75 31.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.387 -0.369 . . . . 73.420000000000002 110.112 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.418 HD23 ' N ' ' A' ' 536' ' ' ALA . 5.4 tt -120.79 127.82 52.31 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.331 -0.618 . . . . 63.039999999999999 109.331 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.555 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -148.55 153.88 39.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.267 -0.424 . . . . 73.549999999999997 110.157 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -119.18 118.86 32.46 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.373 0.606 . . . . 70.129999999999995 110.775 -176.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 44.3 tp -96.86 136.71 37.03 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.942 -1.026 . . . . 75.340000000000003 110.125 -177.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.422 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 65.6 mt -116.77 113.36 42.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.148 -0.478 . . . . 73.099999999999994 109.783 175.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.464 ' HB ' ' HB2' ' A' ' 522' ' ' ALA . 44.1 t -101.74 105.48 18.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.886 -0.597 . . . . 73.319999999999993 109.695 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -88.49 151.15 22.73 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.241 0.543 . . . . 72.129999999999995 111.267 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -76.82 162.76 27.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.261 -0.881 . . . . 73.040000000000006 112.214 -169.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 543' ' ' LYS . . . . . 0.401 ' HB3' ' NZ ' ' A' ' 543' ' ' LYS . 8.2 mtpm? . . . . . 0 C--O 1.251 1.159 0 CA-C-N 115.087 -0.96 . . . . 63.210000000000001 109.174 173.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.756 0 N-CA-C 111.918 -0.473 . . . . 73.409999999999997 111.918 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 43.2 t -113.93 -44.21 3.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.096 0.475 . . . . 71.420000000000002 110.284 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -140.84 157.76 44.92 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.077 -0.511 . . . . 72.409999999999997 110.12 -178.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 21.9 ptt? -86.02 157.93 56.42 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.298 -0.41 . . . . 72.209999999999994 110.119 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -64.79 151.67 84.88 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.162 1.908 . . . . 73.140000000000001 111.447 175.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.45 HG21 ' HB3' ' A' ' 530' ' ' SER . 48.3 t -67.12 110.21 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.809 0.338 . . . . 65.239999999999995 110.597 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 86.6 mt -78.83 130.47 35.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.968 -0.56 . . . . 73.549999999999997 110.524 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 45.7 mm -91.28 110.44 22.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.866 -0.606 . . . . 64.329999999999998 110.057 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 26.3 m -79.95 -28.87 39.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.29 -0.414 . . . . 75.049999999999997 111.346 -176.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.535 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 36.3 mmt-85 -126.35 119.02 23.26 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.61 -0.268 . . . . 63.299999999999997 111.077 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 459' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 458' ' ' ARG . 3.0 Cg_exo -76.06 167.27 26.36 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 123.062 2.508 . . . . 55.109999999999999 111.548 174.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 91.2 mt -81.94 169.58 16.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.646 0.26 . . . . 75.409999999999997 110.609 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -69.57 120.05 14.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.029 -0.532 . . . . 63.100000000000001 111.426 -175.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -93.61 -14.36 26.58 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.861 -0.608 . . . . 65.129999999999995 111.32 178.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.9 pm0 -90.73 157.42 17.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.335 0.588 . . . . 75.349999999999994 111.623 -173.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 10.5 tt -87.48 142.15 28.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.185 -0.916 . . . . 72.140000000000001 110.713 -170.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.487 HG23 HG22 ' A' ' 540' ' ' VAL . 28.9 m -126.75 174.0 11.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.996 -0.547 . . . . 64.109999999999999 110.269 -179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 466' ' ' MET . . . . . 0.509 ' HG2' ' HG3' ' A' ' 541' ' ' GLN . 46.7 mtm -133.13 162.24 32.26 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.418 -0.355 . . . . 74.450000000000003 110.882 -178.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 467' ' ' VAL . . . . . 0.541 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 49.8 t -64.63 137.36 25.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.911 -0.586 . . . . 61.140000000000001 111.618 -176.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 100.93 -0.68 55.09 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.764 -0.731 . . . . 71.400000000000006 114.039 173.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -120.08 159.0 25.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.42 0.61 . . . . 63.240000000000002 110.715 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 470' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 514' ' ' ILE . 37.6 ttm105 -87.38 138.59 31.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 63.140000000000001 111.176 -175.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 47.1 t -115.96 133.34 62.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.92 -0.582 . . . . 62.32 110.454 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -109.21 122.81 48.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.203 -0.453 . . . . 71.140000000000001 110.036 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.653 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 64.9 m-85 -108.31 112.29 24.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.385 -0.371 . . . . 64.030000000000001 110.418 176.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.513 ' HG2' ' CE1' ' A' ' 511' ' ' HIS . 33.7 mt-10 -98.71 120.11 38.59 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.284 -0.636 . . . . 64.200000000000003 109.284 174.005 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.535 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 13.9 t -144.84 109.16 4.84 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.089 -0.708 . . . . 73.340000000000003 109.089 171.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.514 ' OE1' ' HB2' ' A' ' 509' ' ' ARG . 0.4 OUTLIER -113.93 134.63 54.7 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.699 -0.852 . . . . 74.109999999999999 108.699 -176.277 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.532 HG21 ' HB3' ' A' ' 482' ' ' ALA . 30.0 m -95.61 145.23 8.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.567 -0.531 . . . . 60.439999999999998 109.567 176.468 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 32.3 t -72.64 -11.73 60.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.328 -0.396 . . . . 61.310000000000002 111.721 -175.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -133.12 137.62 46.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.846 0.355 . . . . 65.040000000000006 111.886 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -71.01 149.3 46.77 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.855 -0.611 . . . . 75.310000000000002 109.663 174.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 84.42 15.43 68.83 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.663 -0.78 . . . . 72.549999999999997 112.34 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.532 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -91.73 110.47 21.81 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.799 0.333 . . . . 72.049999999999997 110.733 177.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.53 143.89 55.91 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.948 -0.569 . . . . 63.140000000000001 110.515 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 22.3 m -128.62 143.41 41.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.215 -0.448 . . . . 73.540000000000006 110.497 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 485' ' ' LYS . . . . . 0.48 ' HB3' ' HB3' ' A' ' 528' ' ' CYS . 25.1 ttmm -129.09 129.25 44.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.056 -0.52 . . . . 65.120000000000005 110.155 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -98.46 119.77 37.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.124 0.488 . . . . 75.510000000000005 110.762 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 7.8 tt -116.99 119.74 36.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.734 -0.666 . . . . 74.230000000000004 109.331 178.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -105.05 105.73 15.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.418 -0.356 . . . . 74.310000000000002 110.815 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' ASP . . . . . 0.454 ' HB2' ' HA3' ' A' ' 523' ' ' GLY . 4.0 t70 46.88 46.33 15.44 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.257 -0.883 . . . . 65.329999999999998 111.33 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.36 -27.25 20.29 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.743 -0.662 . . . . 72.109999999999999 113.22 177.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 47.5 t -101.5 119.22 49.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 117.12 0.46 . . . . 63.439999999999998 110.775 -176.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -65.32 128.73 37.06 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.725 -0.472 . . . . 71.040000000000006 109.725 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 4.4 pp -91.52 163.13 14.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.758 0.313 . . . . 71.439999999999998 110.301 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 2.4 p -100.05 142.66 31.23 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.086 0.47 . . . . 72.109999999999999 111.583 -176.292 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.41 2.29 9.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.652 -0.703 . . . . 73.230000000000004 111.427 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -126.77 34.68 4.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.156 -0.475 . . . . 62.030000000000001 110.767 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -82.98 -179.94 7.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.892 -0.594 . . . . 61.310000000000002 111.396 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 13.7 t -65.11 165.71 10.77 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.824 -0.626 . . . . 72.239999999999995 111.635 -176.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -74.93 14.26 0.54 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.626 -0.715 . . . . 63.439999999999998 112.603 -173.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -59.15 -44.93 92.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.214 0.53 . . . . 72.420000000000002 110.218 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.428 ' CB ' HG12 ' A' ' 514' ' ' ILE . 1.5 p90 -144.62 125.04 13.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.516 -0.766 . . . . 74.099999999999994 109.681 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -123.26 160.24 27.04 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.831 -0.622 . . . . 70.340000000000003 110.162 -174.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -124.02 151.08 44.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.14 0.495 . . . . 65.099999999999994 111.357 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -117.16 138.27 51.78 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.524 -0.762 . . . . 52.25 109.939 175.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.57 ' NZ ' ' HB3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -113.77 105.1 12.88 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.66 -0.867 . . . . 75.040000000000006 108.66 175.806 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 506' ' ' ASP . . . . . 0.638 ' HB2' ' HG2' ' A' ' 509' ' ' ARG . 32.4 m-20 -115.39 88.36 2.86 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.565 -0.531 . . . . 72.209999999999994 109.565 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 64.15 -94.8 0.16 Allowed Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.873 -0.603 . . . . 52.329999999999998 112.584 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.501 ' O ' HG22 ' A' ' 477' ' ' VAL . 20.2 pt20 -103.31 -20.69 14.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.898 0.38 . . . . 75.150000000000006 111.108 -177.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.638 ' HG2' ' HB2' ' A' ' 506' ' ' ASP . 28.6 ptt180 -92.28 148.87 21.8 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.441 -0.504 . . . . 74.530000000000001 111.075 -172.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -134.47 117.13 15.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.783 -0.644 . . . . 71.129999999999995 109.906 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 511' ' ' HIS . . . . . 0.513 ' CE1' ' HG2' ' A' ' 474' ' ' GLU . 23.1 m-70 -121.22 126.79 50.49 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.806 -0.358 . . . . 71.140000000000001 111.098 -177.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.4 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 58.3 tp -107.33 117.36 33.86 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.107 -0.701 . . . . 72.510000000000005 109.107 176.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 68.6 mt -111.51 108.33 25.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 120.961 0.41 . . . . 71.450000000000003 110.871 -175.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.504 ' O ' ' HG3' ' A' ' 470' ' ' ARG . 35.8 mt -86.86 120.55 36.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.543 -0.91 . . . . 75.230000000000004 108.543 173.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -68.61 -45.88 70.77 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.899 -0.32 . . . . 54.409999999999997 110.715 -176.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -140.61 109.12 5.89 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.641 -0.503 . . . . 72.239999999999995 109.641 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.541 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -64.62 136.43 56.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.954 -0.566 . . . . 72.120000000000005 111.013 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 72.1 mtm -134.16 174.91 9.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.96 -0.563 . . . . 75.430000000000007 110.521 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.463 HD22 ' H ' ' A' ' 519' ' ' LEU . 3.1 mm? -53.53 -33.0 52.96 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.769 0.655 . . . . 64.230000000000004 112.769 -171.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.71 -29.7 68.3 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.412 0.625 . . . . 74.25 111.297 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 521' ' ' ASP . . . . . 0.482 ' HB2' HG21 ' A' ' 540' ' ' VAL . 30.3 m-20 -82.14 -11.86 58.5 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.326 -0.852 . . . . 74.299999999999997 111.462 -170.598 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.497 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -67.22 6.61 0.53 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.394 0.516 . . . . 74.209999999999994 112.394 178.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 523' ' ' GLY . . . . . 0.454 ' HA3' ' HB2' ' A' ' 489' ' ' ASP . . . -80.99 167.99 50.37 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 121.051 -0.595 . . . . 54.340000000000003 112.359 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 524' ' ' HIS . . . . . 0.423 ' CD2' ' HB3' ' A' ' 537' ' ' GLU . 62.8 m80 -79.86 106.58 11.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.688 0.28 . . . . 73.430000000000007 110.935 -178.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -76.57 124.36 27.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.383 0.611 . . . . 74.439999999999998 111.035 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -123.75 135.95 54.14 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.464 -0.789 . . . . 50.149999999999999 109.585 175.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.623 ' HB3' ' HB3' ' A' ' 534' ' ' ALA . 6.2 tt -117.2 108.64 15.91 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.425 -0.583 . . . . 71.230000000000004 109.425 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 528' ' ' CYS . . . . . 0.48 ' HB3' ' HB3' ' A' ' 485' ' ' LYS . 42.3 t -86.76 115.29 24.1 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.051 -0.722 . . . . 65.129999999999995 109.051 176.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.436 HG22 ' H ' ' A' ' 530' ' ' SER . 0.2 OUTLIER -95.3 175.18 6.69 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.501 -0.318 . . . . 64.150000000000006 110.417 -176.908 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 530' ' ' SER . . . . . 0.45 ' HB3' HG21 ' A' ' 454' ' ' VAL . 22.9 t -65.3 -5.99 8.69 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.922 0.391 . . . . 71.099999999999994 111.313 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -149.5 -54.81 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.711 -0.757 . . . . 60.310000000000002 112.469 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -95.47 -171.49 36.31 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.803 -0.713 . . . . 41.43 112.837 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 27.1 pt20 -140.98 136.93 32.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.876 0.37 . . . . 70.239999999999995 110.407 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 534' ' ' ALA . . . . . 0.623 ' HB3' ' HB3' ' A' ' 527' ' ' LEU . . . -115.98 143.52 45.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.119 -0.491 . . . . 61.509999999999998 109.954 176.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 64.3 tp -147.29 126.19 12.75 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.62 -0.264 . . . . 75.209999999999994 110.445 -178.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -150.1 152.01 34.09 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.259 -0.428 . . . . 53.539999999999999 110.208 177.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 537' ' ' GLU . . . . . 0.423 ' HB3' ' CD2' ' A' ' 524' ' ' HIS . 10.4 pt-20 -108.38 113.98 27.48 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.148 0.499 . . . . 73.109999999999999 110.41 178.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.653 HD22 ' HZ ' ' A' ' 473' ' ' PHE . 39.4 tp -96.3 111.43 23.5 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.928 -0.767 . . . . 62.329999999999998 108.928 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 48.4 mt -93.06 112.74 26.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 116.409 -0.36 . . . . 63.240000000000002 110.342 -177.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.487 HG22 HG23 ' A' ' 465' ' ' VAL . 24.6 t -109.4 113.14 43.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.831 -0.622 . . . . 71.140000000000001 109.787 177.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 541' ' ' GLN . . . . . 0.509 ' HG3' ' HG2' ' A' ' 466' ' ' MET . 12.0 pt20 -115.18 157.24 23.93 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.023 0.439 . . . . 72.019999999999996 110.978 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -78.69 135.23 37.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.541 -0.754 . . . . 74.230000000000004 110.282 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 543' ' ' LYS . . . . . 0.444 ' HE2' ' O ' ' A' ' 467' ' ' VAL . 59.0 pttt . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.735 -0.65 . . . . 72.129999999999995 109.901 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.769 0 N-CA-C 111.861 -0.496 . . . . 75.25 111.861 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 6.9 p -67.17 -52.83 36.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.959 0.409 . . . . 70.230000000000004 111.242 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 66.0 m80 -78.73 104.64 9.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.01 -0.541 . . . . 74.230000000000004 110.213 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 452' ' ' MET . . . . . 0.421 ' HA ' ' HD3' ' A' ' 453' ' ' PRO . 44.4 ttm -123.91 119.75 26.68 Favored Pre-proline 0 C--N 1.318 -0.804 0 CA-C-N 115.852 -0.613 . . . . 72.519999999999996 110.544 -175.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 453' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 452' ' ' MET . 6.0 Cg_exo -78.41 158.67 29.3 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.728 2.286 . . . . 74.25 111.405 176.094 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 56.9 t -66.92 112.48 2.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 109.926 -0.398 . . . . 60.210000000000001 109.926 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 89.6 mt -90.06 144.09 26.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.521 . . . . 65.400000000000006 111.458 -175.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.493 HD13 HG12 ' A' ' 477' ' ' VAL . 42.9 mm -104.73 113.6 42.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.649 -0.705 . . . . 75.549999999999997 109.876 178.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 457' ' ' THR . . . . . 0.413 ' OG1' ' HG3' ' A' ' 476' ' ' GLU . 2.9 p -93.8 -4.84 49.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.843 0.354 . . . . 63.439999999999998 111.873 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.618 ' HB2' ' HG2' ' A' ' 476' ' ' GLU . 0.0 OUTLIER -135.02 99.68 12.25 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.562 -0.29 . . . . 74.439999999999998 110.544 177.946 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -71.64 167.15 27.27 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.651 2.234 . . . . 72.299999999999997 111.973 174.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.588 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 79.0 mt -83.66 171.05 13.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.275 -0.42 . . . . 72.030000000000001 111.407 -175.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 461' ' ' GLU . . . . . 0.441 ' HB2' ' HE1' ' A' ' 473' ' ' PHE . 7.8 mm-40 -67.7 118.38 10.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.921 -0.581 . . . . 63.210000000000001 111.089 -179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -95.37 -11.24 28.06 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.908 -0.587 . . . . 74.319999999999993 111.838 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -88.65 157.5 18.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.293 0.568 . . . . 73.430000000000007 111.794 -170.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 8.8 tt -87.24 131.88 34.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.394 -0.821 . . . . 74.209999999999994 110.228 -172.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 33.1 m -124.92 176.24 6.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.871 -0.604 . . . . 71.209999999999994 110.659 -177.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -113.69 157.51 22.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.046 0.451 . . . . 60.43 110.926 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 73.3 t -66.49 138.67 22.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.549 -0.751 . . . . 74.340000000000003 111.272 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.01 -2.06 55.25 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.913 -0.661 . . . . 71.25 114.004 174.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -110.28 163.08 13.99 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 117.671 0.736 . . . . 75.25 111.068 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -82.28 131.03 35.23 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.725 -0.671 . . . . 72.340000000000003 110.863 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 60.7 t -131.61 122.0 49.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.243 -0.435 . . . . 74.200000000000003 110.169 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.62 ' HG2' HG12 ' A' ' 513' ' ' ILE . 21.8 mt-10 -101.68 138.58 38.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.079 0.466 . . . . 64.340000000000003 111.222 176.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.647 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 35.3 m-85 -105.69 112.98 26.27 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.943 -0.762 . . . . 71.230000000000004 108.943 171.104 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.421 ' HB2' ' HE ' ' A' ' 458' ' ' ARG . 42.8 mt-10 -98.29 117.63 33.12 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.467 -0.568 . . . . 63.009999999999998 109.467 179.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.504 ' HA ' ' HB3' ' A' ' 458' ' ' ARG . 22.5 t -132.72 125.28 29.87 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.793 -0.447 . . . . 74.439999999999998 109.793 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.618 ' HG2' ' HB2' ' A' ' 458' ' ' ARG . 11.3 pt-20 -133.08 153.76 51.21 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.958 -0.564 . . . . 73.219999999999999 109.996 178.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.559 HG21 ' HB3' ' A' ' 482' ' ' ALA . 8.1 m -117.37 155.49 19.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 115.465 -0.789 . . . . 64.430000000000007 109.906 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 6.5 p -81.16 -2.44 48.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.056 0.455 . . . . 75.230000000000004 111.638 -177.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -124.4 130.47 52.54 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.604 -0.887 . . . . 71.439999999999998 108.604 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -89.13 132.76 34.67 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.226 0.536 . . . . 45.32 111.605 -174.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 102.73 6.42 46.58 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.81 -0.71 . . . . 24.120000000000001 111.975 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.559 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -82.13 127.53 33.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.694 0.283 . . . . 55.299999999999997 110.481 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -80.09 142.85 34.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.117 -0.492 . . . . 73.329999999999998 110.671 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.54 HG12 HG22 ' A' ' 529' ' ' THR . 35.7 m -124.04 148.77 28.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.965 -0.561 . . . . 71.310000000000002 110.579 -177.725 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 485' ' ' LYS . . . . . 0.41 ' HE3' ' HA ' ' A' ' 485' ' ' LYS . 1.3 tpmt? -127.29 134.84 49.98 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.25 -0.432 . . . . 74.230000000000004 110.238 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -97.85 120.83 38.94 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.941 -0.392 . . . . 74.420000000000002 109.941 177.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 51.0 tp -116.82 120.61 39.05 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.651 -0.5 . . . . 55.25 109.651 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.442 ' HD3' ' C ' ' A' ' 488' ' ' LYS . 14.2 tmtt? -109.3 106.89 16.9 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.862 0.363 . . . . 74.340000000000003 110.599 -176.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.6 t70 51.02 37.86 18.95 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.534 -0.757 . . . . 65.129999999999995 111.871 174.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 91.92 -14.04 65.33 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.769 -0.729 . . . . 52.530000000000001 112.641 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 40.0 t -94.33 130.0 43.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.783 0.325 . . . . 73.120000000000005 110.171 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -89.96 114.66 26.52 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.546 -0.909 . . . . 74.519999999999996 108.546 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.519 ' O ' HD12 ' A' ' 493' ' ' LEU . 2.2 pp -74.0 134.35 43.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.703 0.763 . . . . 75.430000000000007 112.125 -172.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.93 174.53 11.52 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.079 -0.964 . . . . 64.530000000000001 111.265 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 495' ' ' ARG . . . . . 0.462 ' HD3' ' N ' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -115.81 22.58 12.95 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.865 0.32 . . . . 73.340000000000003 111.865 -167.81 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 19.9 pm0 -126.74 20.25 7.15 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.661 0.245 . . . . 74.329999999999998 111.661 -177.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -82.87 159.94 22.26 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.579 0.228 . . . . 75.340000000000003 110.627 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.442 HG23 ' H ' ' A' ' 500' ' ' LYS . 14.2 t -75.83 -179.67 4.95 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.149 0.499 . . . . 71.150000000000006 111.463 -176.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -81.28 19.64 0.93 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.672 0.619 . . . . 55.530000000000001 112.672 -172.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 500' ' ' LYS . . . . . 0.523 ' O ' ' HB3' ' A' ' 515' ' ' ASN . 58.7 tttp -63.17 -21.52 66.26 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.832 -0.803 . . . . 72.109999999999999 108.832 173.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.503 ' HB2' ' HA ' ' A' ' 514' ' ' ILE . 21.1 p90 -155.16 147.42 23.83 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 108.015 -1.105 . . . . 71.510000000000005 108.015 167.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 8.5 p-90 -154.09 159.12 41.36 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.212 -0.292 . . . . 74.239999999999995 110.212 -175.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -111.31 161.24 16.25 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.699 -0.4 . . . . 74.120000000000005 111.309 -177.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.978 ' HG2' ' HB2' ' A' ' 511' ' ' HIS . 14.4 ptpt -129.73 149.54 51.43 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 109.028 -0.73 . . . . 70.439999999999998 109.028 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.45 121.37 44.09 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.853 0.359 . . . . 73.219999999999999 110.509 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -115.97 80.96 1.52 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.568 -0.53 . . . . 62.310000000000002 109.568 175.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.65 -110.33 3.39 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.796 -0.716 . . . . 52.140000000000001 112.293 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -95.28 -5.54 43.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.347 0.594 . . . . 74.329999999999998 110.191 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.57 ' HG2' ' CB ' ' A' ' 476' ' ' GLU . 68.4 mtt85 -100.17 134.15 43.53 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.592 -0.731 . . . . 74.319999999999993 110.546 -175.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -116.51 134.38 54.92 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.825 0.345 . . . . 73.530000000000001 110.511 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 511' ' ' HIS . . . . . 0.978 ' HB2' ' HG2' ' A' ' 504' ' ' LYS . 11.5 m170 -117.91 123.2 45.25 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.15 -0.477 . . . . 74.120000000000005 110.111 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.467 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 46.7 tp -98.26 105.6 17.77 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.452 -0.573 . . . . 61.119999999999997 109.452 172.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.726 HD11 ' HE2' ' A' ' 504' ' ' LYS . 16.4 mt -93.67 107.6 19.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.937 -0.574 . . . . 73.519999999999996 110.451 -176.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.503 ' HA ' ' HB2' ' A' ' 501' ' ' TYR . 45.4 mt -78.13 114.89 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 106.615 -1.624 . . . . 73.25 106.615 168.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 515' ' ' ASN . . . . . 0.523 ' HB3' ' O ' ' A' ' 500' ' ' LYS . 9.3 t30 -72.51 -42.04 65.24 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.356 0.598 . . . . 65.120000000000005 109.838 -176.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -130.95 104.1 6.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.294 -0.866 . . . . 65.310000000000002 109.919 174.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -55.64 133.87 50.83 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.218 -0.66 . . . . 63.219999999999999 109.218 173.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 518' ' ' MET . . . . . 0.524 ' H ' ' HB3' ' A' ' 521' ' ' ASP . 6.9 tpt -134.18 171.53 14.11 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.814 0.34 . . . . 63.0 111.389 -169.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.778 HD11 ' HB2' ' A' ' 542' ' ' GLU . 3.8 mm? -64.75 -49.27 71.43 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.306 -0.406 . . . . 75.040000000000006 111.699 -178.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -67.77 -22.41 65.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.141 0.496 . . . . 63.109999999999999 109.88 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 521' ' ' ASP . . . . . 0.524 ' HB3' ' H ' ' A' ' 518' ' ' MET . 16.6 t70 -74.74 -16.5 60.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.246 -0.888 . . . . 73.420000000000002 111.115 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.448 ' HB2' ' HB ' ' A' ' 540' ' ' VAL . . . -67.96 7.94 0.47 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.788 0.662 . . . . 44.549999999999997 112.788 -178.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -73.77 169.42 53.57 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 121.079 -0.581 . . . . 55.210000000000001 112.111 178.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 65.1 m170 -72.49 147.07 46.39 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.487 -0.42 . . . . 72.530000000000001 110.16 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -119.78 135.53 54.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.143 0.497 . . . . 74.219999999999999 111.431 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.45 ' HB2' ' HG ' ' A' ' 535' ' ' LEU . . . -144.06 135.46 25.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.839 -0.619 . . . . 34.340000000000003 110.637 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 10.5 tt -113.25 129.37 56.54 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.111 -0.7 . . . . 73.200000000000003 109.111 175.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 28.1 t -117.71 137.15 52.88 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.835 0.35 . . . . 74.099999999999994 110.27 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.54 HG22 HG12 ' A' ' 484' ' ' VAL . 67.5 p -109.55 -174.2 2.44 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.026 -0.534 . . . . 74.319999999999993 109.885 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 3.6 m -66.6 -11.17 52.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.167 -0.47 . . . . 65.409999999999997 110.651 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -115.8 -90.47 1.64 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 121.149 -0.548 . . . . 52.130000000000003 112.293 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -104.32 -173.06 25.08 Favored Glycine 0 C--O 1.236 0.221 0 C-N-CA 120.675 -0.774 . . . . 52.299999999999997 112.613 -178.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -133.83 156.74 47.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.895 0.379 . . . . 74.019999999999996 110.802 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -125.62 117.79 24.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.847 -0.615 . . . . 72.129999999999995 109.867 175.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.45 ' HG ' ' HB2' ' A' ' 526' ' ' ALA . 7.2 tt -118.37 132.85 56.25 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.347 -0.388 . . . . 75.219999999999999 110.414 -176.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.588 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -148.79 142.06 25.11 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.831 -0.622 . . . . 75.510000000000005 109.652 176.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -97.74 119.44 36.33 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.405 0.621 . . . . 71.0 111.042 -177.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.647 HD22 ' HZ ' ' A' ' 473' ' ' PHE . 43.8 tp -96.49 112.51 24.23 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.668 -0.697 . . . . 75.430000000000007 109.319 177.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 52.9 mt -93.64 112.16 26.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.694 -0.484 . . . . 63.109999999999999 109.694 178.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.448 ' HB ' ' HB2' ' A' ' 522' ' ' ALA . 23.4 t -106.16 110.97 33.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.111 -0.495 . . . . 73.099999999999994 110.138 -179.178 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -94.11 138.4 32.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.09 -0.505 . . . . 74.510000000000005 110.789 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 542' ' ' GLU . . . . . 0.779 ' HG2' ' HD3' ' A' ' 543' ' ' LYS . 21.3 tt0 -79.18 159.46 27.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.3 -0.409 . . . . 71.230000000000004 109.919 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 543' ' ' LYS . . . . . 0.779 ' HD3' ' HG2' ' A' ' 542' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.473 -0.775 . . . . 51.509999999999998 110.498 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.652 0 N-CA-C 111.872 -0.491 . . . . 64.040000000000006 111.872 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 4.9 m -69.99 -59.7 2.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.462 0.172 . . . . 74.209999999999994 111.433 -176.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 72.9 m-70 61.16 29.04 18.6 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.486 0.66 . . . . 61.200000000000003 110.366 -174.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' MET . . . . . 0.402 ' HB3' ' HD2' ' A' ' 453' ' ' PRO . 66.2 mtt -109.57 167.28 9.34 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.423 -0.808 . . . . 71.340000000000003 109.657 -178.181 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 453' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 452' ' ' MET . 53.7 Cg_exo -53.92 155.07 15.44 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.297 1.998 . . . . 71.209999999999994 111.737 174.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.435 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 30.6 t -65.94 123.75 19.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.419 -0.355 . . . . 54.409999999999997 110.275 -177.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 6.6 mp -78.55 140.22 38.54 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.953 -0.567 . . . . 50.130000000000003 110.859 -177.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.588 HG13 ' HB2' ' A' ' 534' ' ' ALA . 33.7 mm -91.86 112.04 25.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.577 -0.738 . . . . 62.119999999999997 109.432 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 457' ' ' THR . . . . . 0.421 ' OG1' ' HG3' ' A' ' 476' ' ' GLU . 0.4 OUTLIER -85.29 -25.62 27.1 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.095 0.405 . . . . 64.430000000000007 112.095 -177.041 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.502 ' HB2' ' HG2' ' A' ' 476' ' ' GLU . 6.4 mmm180 -130.61 111.66 16.32 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 110.096 -0.335 . . . . 72.450000000000003 110.096 177.184 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.15 168.5 23.9 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.966 2.444 . . . . 75.129999999999995 112.019 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.499 HD21 ' HB2' ' A' ' 527' ' ' LEU . 3.5 mm? -80.22 160.08 25.72 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.924 -0.398 . . . . 51.030000000000001 109.924 -178.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 461' ' ' GLU . . . . . 0.591 ' HG2' ' HD1' ' A' ' 473' ' ' PHE . 27.1 mm-40 -58.55 119.02 6.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.904 -0.589 . . . . 73.030000000000001 111.071 -176.04 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -93.15 -10.94 34.08 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.675 -0.693 . . . . 72.140000000000001 111.616 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 463' ' ' GLN . . . . . 0.575 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 6.0 pm0 -88.53 156.51 19.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.117 0.484 . . . . 73.120000000000005 111.254 -174.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 10.5 tt -87.07 138.39 31.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.661 -0.7 . . . . 61.200000000000003 110.981 -168.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.559 HG22 HD11 ' A' ' 538' ' ' LEU . 29.7 m -125.98 177.6 5.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.74 -0.664 . . . . 72.120000000000005 110.809 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 466' ' ' MET . . . . . 0.49 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 38.1 mtm -133.62 156.1 48.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.758 0.314 . . . . 74.310000000000002 111.202 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 467' ' ' VAL . . . . . 0.491 ' CG2' ' HA ' ' A' ' 542' ' ' GLU . 55.8 t -64.53 144.47 14.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.684 -0.689 . . . . 71.200000000000003 111.768 -178.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 102.26 -25.25 28.37 Favored Glycine 0 C--N 1.332 0.307 0 CA-C-N 115.948 -0.569 . . . . 70.450000000000003 113.627 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 466' ' ' MET . 13.2 pt20 -98.23 168.35 10.29 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 117.237 0.519 . . . . 62.299999999999997 110.365 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 24.9 ttm180 -84.93 136.66 33.53 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.913 -0.403 . . . . 73.030000000000001 109.913 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 23.4 t -122.09 122.12 65.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.619 -0.511 . . . . 70.519999999999996 109.619 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.55 ' HG2' HG23 ' A' ' 513' ' ' ILE . 49.5 mt-10 -116.54 128.47 55.46 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.74 0.305 . . . . 72.200000000000003 110.56 -178.3 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.714 ' HD2' HD23 ' A' ' 512' ' ' LEU . 20.0 m-85 -105.06 127.15 52.75 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.327 -0.62 . . . . 65.409999999999997 109.327 179.069 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -111.55 116.75 31.36 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.109 0.481 . . . . 70.219999999999999 110.048 176.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 25.9 p -138.74 158.21 44.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.678 -0.692 . . . . 62.229999999999997 110.042 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.511 ' HB3' ' HG2' ' A' ' 509' ' ' ARG . 7.8 pt-20 -161.24 170.55 20.04 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.368 -0.378 . . . . 72.209999999999994 110.16 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.657 HG21 ' HB3' ' A' ' 482' ' ' ALA . 19.9 m -126.16 168.48 19.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.641 -0.708 . . . . 73.219999999999999 109.827 177.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 7.8 t -81.26 -1.05 43.49 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.439 -0.346 . . . . 42.109999999999999 111.322 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -117.2 133.96 55.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.087 0.47 . . . . 73.409999999999997 110.691 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -71.75 124.78 25.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 74.420000000000002 111.668 -175.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 71.72 31.91 64.62 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.108 -0.568 . . . . 71.120000000000005 113.284 174.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.657 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -81.56 133.37 35.37 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 122.607 -0.349 . . . . 74.430000000000007 110.535 176.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -68.23 142.49 55.62 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.695 -0.684 . . . . 74.439999999999998 110.395 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.524 HG12 HG22 ' A' ' 529' ' ' THR . 27.4 m -124.9 146.34 30.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.198 0.523 . . . . 71.099999999999994 110.76 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -117.9 135.53 54.05 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.412 -0.813 . . . . 74.430000000000007 109.053 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 486' ' ' TRP . . . . . 0.577 ' HB3' HD12 ' A' ' 493' ' ' LEU . 99.2 m95 -98.05 121.42 39.95 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.219 0.533 . . . . 75.049999999999997 110.312 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 20.2 tp -116.11 151.68 35.13 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.409 -0.814 . . . . 73.010000000000005 109.292 -178.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -136.86 105.22 5.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.803 0.335 . . . . 73.340000000000003 110.454 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 16.0 t70 47.13 40.22 9.49 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.326 -0.852 . . . . 74.439999999999998 111.663 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.47 -26.3 24.38 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.808 -0.711 . . . . 71.439999999999998 113.212 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 57.9 t -91.64 135.82 26.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 110.032 -0.359 . . . . 51.5 110.032 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -83.53 136.08 34.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.522 0.201 . . . . 75.519999999999996 110.564 -177.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.577 HD12 ' HB3' ' A' ' 486' ' ' TRP . 70.1 mt -69.09 153.89 42.98 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.946 -0.39 . . . . 72.219999999999999 109.946 178.053 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 494' ' ' THR . . . . . 0.522 HG22 ' HG2' ' A' ' 496' ' ' GLU . 1.3 m -74.98 142.19 43.92 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.19 0.519 . . . . 74.400000000000006 112.104 -170.256 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 10.6 ptp85 -68.44 -20.75 64.66 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.744 -0.662 . . . . 75.040000000000006 110.431 175.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 496' ' ' GLU . . . . . 0.522 ' HG2' HG22 ' A' ' 494' ' ' THR . 9.1 pt-20 -116.52 39.11 3.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.278 -0.874 . . . . 73.140000000000001 109.204 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 497' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 494' ' ' THR . 7.3 tp10 -62.85 154.88 28.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.192 -0.913 . . . . 70.540000000000006 111.568 -174.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 9.6 t -60.22 150.6 29.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.511 -0.768 . . . . 73.439999999999998 111.396 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -86.23 18.25 3.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.002 -0.544 . . . . 71.219999999999999 111.248 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 500' ' ' LYS . . . . . 0.418 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 39.6 tttp -72.61 -24.24 61.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.358 -0.608 . . . . 71.099999999999994 109.358 177.408 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.483 ' CB ' ' HA ' ' A' ' 514' ' ' ILE . 13.4 p90 -146.14 138.52 25.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.285 -0.871 . . . . 64.209999999999994 108.96 173.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -135.39 160.24 39.05 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.855 0.359 . . . . 70.140000000000001 111.446 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 503' ' ' PHE . . . . . 0.439 ' HB3' HD13 ' A' ' 512' ' ' LEU . 40.8 p90 -119.17 138.26 53.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.115 0.483 . . . . 75.340000000000003 110.734 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -116.89 131.4 56.96 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.707 -0.678 . . . . 60.229999999999997 110.274 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -101.53 128.47 47.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.419 -0.355 . . . . 71.25 110.653 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -135.56 81.75 1.91 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.075 -0.511 . . . . 64.049999999999997 109.742 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 75.14 -118.0 5.47 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 121.007 -0.616 . . . . 75.049999999999997 112.151 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -86.11 -13.88 45.9 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.94 0.4 . . . . 75.310000000000002 110.407 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.511 ' HG2' ' HB3' ' A' ' 476' ' ' GLU . 70.6 mtt180 -97.58 139.14 33.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.408 0.623 . . . . 74.140000000000001 111.497 -174.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -130.44 119.18 22.29 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.401 -0.818 . . . . 70.219999999999999 109.638 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 41.7 m-70 -105.54 124.91 50.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.438 -0.346 . . . . 63.43 110.189 -177.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.714 HD23 ' HD2' ' A' ' 473' ' ' PHE . 50.6 tp -106.31 105.86 16.1 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.696 -0.483 . . . . 71.030000000000001 109.696 176.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.55 HG23 ' HG2' ' A' ' 472' ' ' GLU . 4.8 mp -101.75 110.6 28.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 116.187 -0.461 . . . . 71.329999999999998 110.622 -174.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.483 ' HA ' ' CB ' ' A' ' 501' ' ' TYR . 55.4 mt -92.4 116.99 34.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 108.575 -0.898 . . . . 74.5 108.575 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -70.64 -42.76 70.43 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.1 -0.5 . . . . 61.240000000000002 111.345 -175.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 516' ' ' GLU . . . . . 0.418 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 26.2 mt-10 -134.17 105.24 6.56 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.871 -0.604 . . . . 63.420000000000002 109.627 -178.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.469 ' O ' HG13 ' A' ' 467' ' ' VAL . . . -56.53 123.04 13.43 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.548 0.53 . . . . 60.109999999999999 110.306 177.388 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 14.4 tpt -113.81 169.09 9.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.133 -0.485 . . . . 73.209999999999994 110.111 -175.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 1.004 ' HG ' ' HG2' ' A' ' 542' ' ' GLU . 7.2 mp -58.12 -33.04 68.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.108 0.48 . . . . 55.509999999999998 110.491 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -60.91 -32.48 71.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.473 -0.785 . . . . 74.140000000000001 112.233 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -69.32 -14.23 62.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.766 0.317 . . . . 75.299999999999997 111.818 -172.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -62.71 -23.23 67.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.086 0.469 . . . . 74.200000000000003 110.088 172.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -67.54 123.73 20.35 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.824 -0.91 . . . . 23.210000000000001 110.824 173.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -66.76 125.74 26.82 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.127 0.489 . . . . 45.119999999999997 111.694 -170.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -92.95 152.48 19.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.594 -0.73 . . . . 65.140000000000001 110.522 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.51 143.24 43.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.965 -0.561 . . . . 74.099999999999994 110.744 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.499 ' HB2' HD21 ' A' ' 460' ' ' LEU . 58.6 tp -100.97 114.13 27.75 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.049 -0.523 . . . . 61.32 109.907 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 42.3 t -112.89 128.82 56.57 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.191 -0.459 . . . . 63.399999999999999 110.08 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.524 HG22 HG12 ' A' ' 484' ' ' VAL . 75.8 p -114.69 -174.3 2.46 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.492 -0.559 . . . . 74.109999999999999 109.492 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 12.4 p -68.0 -8.93 41.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.65 -0.25 . . . . 60.200000000000003 111.575 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -143.68 -48.55 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.705 -0.759 . . . . 21.329999999999998 113.301 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -98.74 156.97 20.22 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.646 -0.788 . . . . 54.0 113.121 -174.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -131.99 125.43 31.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.368 0.267 . . . . 73.329999999999998 110.292 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 534' ' ' ALA . . . . . 0.588 ' HB2' HG13 ' A' ' 456' ' ' ILE . . . -121.53 118.1 28.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.708 -0.224 . . . . 53.43 110.791 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 64.0 tp -109.66 138.96 45.27 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.996 0.427 . . . . 74.409999999999997 110.622 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -139.52 145.17 38.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.758 -0.656 . . . . 24.399999999999999 109.557 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -105.63 110.0 22.16 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.544 0.688 . . . . 73.310000000000002 110.458 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.559 HD11 HG22 ' A' ' 465' ' ' VAL . 49.1 tp -103.39 132.58 49.53 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.534 -0.757 . . . . 72.200000000000003 110.037 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.555 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 67.8 mt -117.85 112.92 40.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.723 -0.473 . . . . 72.519999999999996 109.723 176.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.438 HG22 HG23 ' A' ' 465' ' ' VAL . 45.8 t -108.39 108.65 25.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.302 -0.408 . . . . 75.409999999999997 110.244 -179.212 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -85.55 134.08 34.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.921 0.391 . . . . 63.43 110.41 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 542' ' ' GLU . . . . . 1.004 ' HG2' ' HG ' ' A' ' 519' ' ' LEU . 1.0 OUTLIER -83.95 149.82 26.06 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.706 -0.679 . . . . 62.229999999999997 111.404 -174.325 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 C--O 1.249 1.046 0 CA-C-N 115.58 -0.736 . . . . 75.209999999999994 109.532 175.234 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.698 0 N-CA-C 112.03 -0.428 . . . . 62.43 112.03 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 41.2 t -82.57 -75.04 0.32 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.032 0.444 . . . . 73.140000000000001 110.098 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 30.0 m-70 -124.28 13.87 8.94 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.302 0.573 . . . . 74.519999999999996 110.063 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 452' ' ' MET . . . . . 0.46 ' HA ' ' HD3' ' A' ' 453' ' ' PRO . 25.9 mmt -88.37 138.12 30.46 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 115.508 -0.769 . . . . 74.239999999999995 109.361 176.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 453' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 452' ' ' MET . 25.4 Cg_exo -62.96 159.15 39.62 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 122.701 2.268 . . . . 62.399999999999999 112.494 -178.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.452 ' H ' ' HA3' ' A' ' 531' ' ' GLY . 57.3 t -66.87 116.11 5.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.982 -0.553 . . . . 73.510000000000005 109.583 175.524 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.31 153.14 17.82 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.045 0.45 . . . . 70.239999999999995 110.977 -174.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.416 HG22 ' H ' ' A' ' 458' ' ' ARG . 27.7 mm -105.76 117.83 52.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.785 -0.643 . . . . 74.140000000000001 109.733 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 457' ' ' THR . . . . . 0.58 ' CG2' ' HB2' ' A' ' 476' ' ' GLU . 15.1 t -91.26 2.63 56.23 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.271 0.558 . . . . 65.329999999999998 110.763 -177.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.428 ' HB2' ' H ' ' A' ' 476' ' ' GLU . 75.4 mmt-85 -138.84 94.5 10.14 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.708 -0.678 . . . . 71.209999999999994 109.663 173.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -67.45 157.31 62.37 Favored 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.479 2.12 . . . . 70.319999999999993 111.467 178.264 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.434 HD12 ' HB3' ' A' ' 473' ' ' PHE . 3.1 mm? -80.96 146.66 30.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.357 -0.609 . . . . 53.299999999999997 109.357 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 461' ' ' GLU . . . . . 0.657 ' HB2' ' OE1' ' A' ' 463' ' ' GLN . 6.0 pt-20 -82.91 126.77 32.86 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.968 0.889 . . . . 73.120000000000005 112.462 -171.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -92.55 -6.94 48.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 113.934 -1.485 . . . . 64.25 112.791 -173.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 463' ' ' GLN . . . . . 0.657 ' OE1' ' HB2' ' A' ' 461' ' ' GLU . 4.6 pm0 -83.73 161.33 21.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.294 0.569 . . . . 75.200000000000003 110.954 -169.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.834 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 1.2 tt -84.72 132.1 34.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.339 -0.846 . . . . 63.200000000000003 111.609 -161.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 33.0 m -120.81 177.73 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.357 -0.838 . . . . 63.0 109.693 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' MET . . . . . 0.453 ' O ' ' HB3' ' A' ' 469' ' ' GLN . 23.0 ptp -124.5 163.11 22.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.696 0.284 . . . . 75.010000000000005 111.017 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 467' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 541' ' ' GLN . 59.6 t -62.53 130.31 26.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 70.129999999999995 111.179 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 468' ' ' GLY . . . . . 0.445 ' HA2' ' HB3' ' A' ' 516' ' ' GLU . . . 93.48 -11.88 70.65 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.937 -0.649 . . . . 72.430000000000007 112.353 178.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.453 ' HB3' ' O ' ' A' ' 466' ' ' MET . 29.5 tt0 -76.31 132.37 39.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.951 0.405 . . . . 72.120000000000005 111.035 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -73.86 127.04 31.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.609 -0.723 . . . . 74.040000000000006 110.251 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 47.5 t -132.52 126.86 55.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.202 -0.454 . . . . 65.239999999999995 110.601 -178.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -103.86 131.07 51.42 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.126 -0.324 . . . . 72.340000000000003 110.126 174.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.434 ' HB3' HD12 ' A' ' 460' ' ' LEU . 55.0 m-85 -107.07 110.98 23.24 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.124 -0.489 . . . . 71.430000000000007 109.748 176.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -104.97 129.86 53.29 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.346 -0.388 . . . . 73.409999999999997 110.296 -178.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 9.0 p -143.46 111.68 6.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.219 0.533 . . . . 64.129999999999995 110.292 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.58 ' HB2' ' CG2' ' A' ' 457' ' ' THR . 2.0 mm-40 -108.51 132.23 54.03 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.125 -0.694 . . . . 74.239999999999995 109.125 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.458 HG22 ' O ' ' A' ' 508' ' ' GLN . 34.9 m -95.33 144.64 9.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 110.044 -0.354 . . . . 63.399999999999999 110.044 179.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 58.9 p -85.79 -2.59 58.38 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.81 0.338 . . . . 63.219999999999999 111.446 -177.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -124.04 133.16 53.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.334 -0.394 . . . . 73.109999999999999 110.222 -178.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -77.98 150.13 33.98 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.018 -0.364 . . . . 65.430000000000007 110.018 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 84.41 16.29 66.86 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.495 -0.859 . . . . 41.340000000000003 112.116 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.44 110.89 22.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.964 0.411 . . . . 72.010000000000005 110.535 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 483' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 529' ' ' THR . 27.2 mp0 -80.97 157.92 25.37 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.126 -0.694 . . . . 71.120000000000005 109.126 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.554 HG12 HG22 ' A' ' 529' ' ' THR . 24.5 m -128.1 143.16 41.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.246 0.546 . . . . 62.210000000000001 111.579 -175.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 485' ' ' LYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 21.5 ttmm -127.59 131.69 49.92 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.404 -0.816 . . . . 72.25 109.37 174.18 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 486' ' ' TRP . . . . . 0.462 ' HB2' HD11 ' A' ' 493' ' ' LEU . 98.0 m95 -98.17 115.91 29.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.303 0.573 . . . . 74.219999999999999 110.258 178.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 37.3 tp -116.63 120.89 40.08 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.342 -0.844 . . . . 73.219999999999999 109.501 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.473 ' HE2' ' HA3' ' A' ' 523' ' ' GLY . 13.3 tmtt? -109.44 106.65 16.49 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.466 -0.494 . . . . 73.400000000000006 110.311 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.08 38.31 20.36 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.164 -0.926 . . . . 73.299999999999997 111.808 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.73 -24.16 32.12 Favored Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.87 -0.681 . . . . 71.140000000000001 112.586 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.6 t -89.7 124.84 42.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 110.072 -0.344 . . . . 64.120000000000005 110.072 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -89.62 119.66 30.24 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.428 -0.582 . . . . 64.239999999999995 109.428 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.462 HD11 ' HB2' ' A' ' 486' ' ' TRP . 2.4 pp -72.73 161.64 30.49 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.199 -0.455 . . . . 65.120000000000005 111.395 -177.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 494' ' ' THR . . . . . 0.5 ' O ' ' HB2' ' A' ' 497' ' ' GLU . 19.1 m -106.85 142.72 36.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.98 -0.554 . . . . 75.420000000000002 110.241 -178.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 495' ' ' ARG . . . . . 0.415 ' HD3' ' C ' ' A' ' 495' ' ' ARG . 4.3 tmt_? -65.19 -39.91 93.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.345 -0.613 . . . . 64.349999999999994 109.345 176.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 496' ' ' GLU . . . . . 0.439 ' H ' HG22 ' A' ' 494' ' ' THR . 1.3 mp0 -76.25 73.14 3.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.936 -0.575 . . . . 62.229999999999997 109.898 171.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 497' ' ' GLU . . . . . 0.5 ' HB2' ' O ' ' A' ' 494' ' ' THR . 5.0 tp10 -120.21 179.58 4.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.585 -0.734 . . . . 75.230000000000004 109.44 -177.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.426 ' H ' ' HG3' ' A' ' 497' ' ' GLU . 11.2 t -72.5 172.64 10.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.703 0.287 . . . . 72.549999999999997 110.345 175.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -79.13 18.21 0.68 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.816 0.341 . . . . 72.409999999999997 111.791 -173.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -61.4 -35.13 76.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 72.349999999999994 111.189 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.534 ' HD2' HD11 ' A' ' 512' ' ' LEU . 25.1 p90 -148.57 150.2 32.92 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.297 -0.411 . . . . 74.219999999999999 110.616 -177.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -146.6 142.64 28.16 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.479 -0.563 . . . . 72.450000000000003 109.479 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 503' ' ' PHE . . . . . 0.51 ' HB3' HD13 ' A' ' 512' ' ' LEU . 44.1 p90 -123.3 150.03 44.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.131 0.491 . . . . 74.329999999999998 111.34 -176.273 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -127.92 139.7 52.44 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.368 -0.833 . . . . 64.109999999999999 110.023 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.2 pptp? -111.07 137.78 48.3 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.691 -0.485 . . . . 75.430000000000007 109.691 173.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 506' ' ' ASP . . . . . 0.633 ' HB3' ' HB2' ' A' ' 509' ' ' ARG . 33.8 t70 -130.45 82.86 2.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.784 -0.644 . . . . 75.25 109.382 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.34 -107.99 2.25 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.704 -0.76 . . . . 65.340000000000003 111.661 -174.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.458 ' O ' HG22 ' A' ' 477' ' ' VAL . 15.9 pt20 -89.32 -7.44 55.33 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.454 0.645 . . . . 74.109999999999999 110.151 177.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.633 ' HB2' ' HB3' ' A' ' 506' ' ' ASP . 67.8 mtp180 -91.08 147.12 23.29 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.641 -0.709 . . . . 71.439999999999998 111.071 -172.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -141.72 115.72 9.29 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.36 -0.607 . . . . 75.319999999999993 109.36 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -124.33 122.51 37.91 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.68 0.276 . . . . 64.319999999999993 110.574 -175.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.534 HD11 ' HD2' ' A' ' 501' ' ' TYR . 57.4 tp -107.86 126.54 52.79 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.137 -0.483 . . . . 52.020000000000003 110.315 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.42 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.2 mp -108.76 113.84 45.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 120.954 0.406 . . . . 73.439999999999998 110.737 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 514' ' ' ILE . . . . . . . . . . . . . 35.5 mm -91.36 121.84 42.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.874 -0.787 . . . . 72.409999999999997 108.874 174.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -66.64 -51.49 55.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.81 0.338 . . . . 72.239999999999995 110.397 -177.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 516' ' ' GLU . . . . . 0.445 ' HB3' ' HA2' ' A' ' 468' ' ' GLY . 46.4 mt-10 -145.4 123.55 12.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.917 -0.583 . . . . 72.450000000000003 110.131 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -66.48 133.71 50.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.128 -0.487 . . . . 50.340000000000003 110.999 178.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 518' ' ' MET . . . . . 0.449 ' HG2' ' H ' ' A' ' 520' ' ' GLU . 55.1 ttm -113.67 155.96 24.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.891 -0.595 . . . . 75.439999999999998 109.621 -178.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.702 HD21 ' HB3' ' A' ' 542' ' ' GLU . 84.8 mt -58.81 -32.5 69.43 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.935 0.397 . . . . 51.240000000000002 111.623 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 520' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' A' ' 518' ' ' MET . 0.9 OUTLIER -60.41 -28.58 68.37 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.143 0.497 . . . . 74.010000000000005 110.691 178.454 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 521' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 523' ' ' GLY . 56.7 m-20 -71.32 -11.95 61.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.767 -0.651 . . . . 74.430000000000007 112.197 -175.244 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.489 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -61.66 5.54 0.08 Allowed 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.576 0.584 . . . . 72.019999999999996 112.576 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 523' ' ' GLY . . . . . 0.473 ' HA3' ' HE2' ' A' ' 488' ' ' LYS . . . -83.91 170.56 47.81 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 116.415 -0.357 . . . . 71.150000000000006 112.367 177.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 44.4 m-70 -73.69 118.56 16.79 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 122.65 -0.324 . . . . 72.209999999999994 110.559 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 525' ' ' TYR . . . . . 0.441 ' HB2' ' O ' ' A' ' 536' ' ' ALA . 56.8 m-85 -83.75 133.73 34.77 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.957 -0.386 . . . . 72.450000000000003 109.957 172.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.57 134.23 46.84 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.867 0.365 . . . . 70.140000000000001 110.514 175.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.548 HD11 ' HB ' ' A' ' 484' ' ' VAL . 57.1 tp -110.33 106.52 15.93 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.866 -0.606 . . . . 72.400000000000006 109.939 177.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 528' ' ' CYS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 48.7 m -92.52 115.11 27.8 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.218 -0.446 . . . . 73.420000000000002 110.113 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.554 HG22 HG12 ' A' ' 484' ' ' VAL . 44.3 p -109.11 -175.01 2.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.909 0.385 . . . . 73.540000000000006 110.601 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 14.5 m -72.65 -5.92 40.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.082 -0.508 . . . . 74.319999999999993 110.965 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 531' ' ' GLY . . . . . 0.452 ' HA3' ' H ' ' A' ' 454' ' ' VAL . . . -138.43 -90.38 0.22 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.653 -0.784 . . . . 75.219999999999999 112.785 -178.106 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -97.46 127.28 9.16 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.631 -0.795 . . . . 51.200000000000003 112.455 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -95.55 127.1 41.31 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.059 0.457 . . . . 71.140000000000001 110.814 178.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -97.23 140.03 32.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.006 -0.543 . . . . 72.409999999999997 110.044 178.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 6.0 tt -129.58 123.78 32.18 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.724 -0.473 . . . . 75.299999999999997 109.724 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.441 ' O ' ' HB2' ' A' ' 525' ' ' TYR . . . -145.07 134.76 23.43 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.724 -0.671 . . . . 74.400000000000006 109.687 177.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 537' ' ' GLU . . . . . 0.438 ' H ' ' HG2' ' A' ' 537' ' ' GLU . 4.4 pt-20 -105.17 137.72 42.5 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 120.844 0.354 . . . . 73.019999999999996 110.474 -176.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 522' ' ' ALA . 45.4 tp -96.4 133.95 40.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.879 -0.601 . . . . 60.219999999999999 110.201 -174.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.834 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 7.6 mt -104.06 123.78 58.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.98 -0.748 . . . . 63.43 108.98 177.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 45.6 t -118.74 126.37 75.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.584 -0.28 . . . . 75.109999999999999 111.22 -174.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 541' ' ' GLN . . . . . 0.574 ' HG3' ' CD2' ' A' ' 464' ' ' LEU . 74.8 mt-30 -84.82 127.73 34.28 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 116.361 -0.381 . . . . 73.129999999999995 111.189 175.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 542' ' ' GLU . . . . . 0.702 ' HB3' HD21 ' A' ' 519' ' ' LEU . 6.9 pt-20 -91.12 126.81 36.32 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.512 -1.292 . . . . 74.219999999999999 107.512 163.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp . . . . . 0 C--N 1.315 -0.92 0 CA-C-O 118.865 -0.588 . . . . 62.240000000000002 109.736 -176.609 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 111.361 -0.696 . . . . 70.150000000000006 111.361 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 17.3 m -78.95 140.37 38.05 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.619 -0.512 . . . . 73.019999999999996 109.619 176.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.32 146.06 53.63 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.747 -0.381 . . . . 71.329999999999998 110.31 -179.308 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 66.4 mtt -63.92 154.26 82.0 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.059 -0.519 . . . . 71.140000000000001 110.141 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.53 148.03 21.52 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.812 2.341 . . . . 71.209999999999994 111.794 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.418 ' H ' ' HA3' ' A' ' 531' ' ' GLY . 43.1 t -66.26 106.34 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.112 -0.494 . . . . 63.409999999999997 110.219 -177.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 93.6 mt -82.57 147.29 28.7 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.605 -0.725 . . . . 73.409999999999997 110.163 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.788 HG13 ' HB2' ' A' ' 534' ' ' ALA . 40.7 mm -94.79 117.35 38.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.942 -0.572 . . . . 73.409999999999997 109.908 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 457' ' ' THR . . . . . 0.496 HG22 ' NH2' ' A' ' 458' ' ' ARG . 3.3 m -83.28 -35.63 25.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.218 -0.447 . . . . 70.340000000000003 110.583 -177.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.717 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 14.2 mmp_? -115.42 105.57 52.04 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 109.566 -0.531 . . . . 74.120000000000005 109.566 176.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -70.75 160.61 48.85 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.784 2.323 . . . . 64.219999999999999 111.785 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.481 ' HB2' ' CB ' ' A' ' 536' ' ' ALA . 94.8 mt -81.77 169.4 16.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.763 0.316 . . . . 65.329999999999998 110.98 -177.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -64.7 118.12 8.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.961 -0.563 . . . . 43.130000000000003 111.444 -175.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -94.76 -11.75 28.43 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.865 -0.607 . . . . 72.420000000000002 111.503 177.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -89.51 159.73 17.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.196 0.522 . . . . 74.239999999999995 111.778 -171.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.41 ' C ' HD23 ' A' ' 464' ' ' LEU . 8.4 tt -85.81 137.06 33.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.51 -0.768 . . . . 74.319999999999993 110.258 -173.219 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.628 HG23 HG23 ' A' ' 540' ' ' VAL . 22.8 m -130.45 175.99 9.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.623 -0.717 . . . . 64.439999999999998 110.476 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 466' ' ' MET . . . . . 0.493 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 65.8 mtt -111.21 150.74 29.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.638 0.256 . . . . 70.5 110.975 -178.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.5 142.56 16.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.303 -0.408 . . . . 41.43 110.72 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.06 -25.49 28.12 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.946 -0.645 . . . . 42.219999999999999 113.635 175.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 466' ' ' MET . 13.1 pt20 -89.26 164.82 14.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.25 0.525 . . . . 64.439999999999998 110.444 -178.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 470' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 514' ' ' ILE . 33.9 ttm180 -88.81 129.39 35.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.909 0.385 . . . . 71.549999999999997 111.215 -174.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -124.92 139.92 49.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.495 . . . . 72.109999999999999 110.206 -177.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -125.69 134.12 51.93 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.753 0.311 . . . . 55.420000000000002 110.643 -178.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.767 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 81.8 m-85 -107.12 116.32 31.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.207 -0.451 . . . . 70.040000000000006 110.625 177.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -100.06 118.14 35.81 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.628 -0.715 . . . . 71.239999999999995 109.606 177.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.717 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 27.6 t -134.89 141.29 46.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.299 0.571 . . . . 64.340000000000003 111.305 -178.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.621 ' HG3' ' HG2' ' A' ' 509' ' ' ARG . 42.7 tt0 -138.45 136.85 36.62 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.298 -1.001 . . . . 74.340000000000003 108.298 176.016 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.531 HG21 ' HB3' ' A' ' 482' ' ' ALA . 18.0 m -104.07 154.68 5.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 C-N-CA 121.167 -0.213 . . . . 64.219999999999999 110.459 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 45.4 m -82.61 -2.22 53.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.814 0.34 . . . . 74.209999999999994 111.622 -178.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -111.21 141.29 44.92 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.612 -0.514 . . . . 73.140000000000001 109.612 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -86.24 138.41 31.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.153 -0.476 . . . . 74.420000000000002 111.202 -173.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 62.13 39.1 97.2 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.922 -0.656 . . . . 65.430000000000007 112.212 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.531 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -103.34 112.03 24.72 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.078 0.466 . . . . 71.140000000000001 111.065 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -73.31 154.31 40.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.594 -0.73 . . . . 73.329999999999998 109.594 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.423 HG12 HG22 ' A' ' 529' ' ' THR . 35.7 m -124.63 161.26 28.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.897 0.379 . . . . 72.549999999999997 111.022 -175.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 485' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 527' ' ' LEU . 12.3 ttmm -116.64 128.77 55.69 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.731 -0.668 . . . . 44.450000000000003 109.682 177.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 486' ' ' TRP . . . . . 0.41 ' HB2' HD21 ' A' ' 493' ' ' LEU . 89.9 m95 -98.82 115.35 28.61 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.306 -0.627 . . . . 75.530000000000001 109.306 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 28.6 tp -119.6 119.2 33.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.032 -0.531 . . . . 63.109999999999999 110.393 -177.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.481 ' HD3' ' O ' ' A' ' 488' ' ' LYS . 13.3 tmtt? -109.74 106.79 16.56 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.013 -0.366 . . . . 71.329999999999998 110.013 177.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.1 t70 49.19 38.46 13.32 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.461 0.648 . . . . 74.209999999999994 111.491 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.45 -17.21 58.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.707 -0.759 . . . . 64.120000000000005 113.014 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.6 t -84.89 117.14 29.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.803 0.302 . . . . 74.340000000000003 110.729 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -97.89 117.67 32.75 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.44 -0.578 . . . . 53.530000000000001 109.44 176.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.41 HD21 ' HB2' ' A' ' 486' ' ' TRP . 1.9 pp -73.97 163.11 28.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.177 0.513 . . . . 73.540000000000006 112.008 -175.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 34.9 p -106.72 174.42 5.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.619 -0.719 . . . . 70.120000000000005 111.541 -177.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -63.14 -47.47 82.58 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.324 0.583 . . . . 75.219999999999999 111.202 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -95.52 50.51 1.24 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.824 -0.625 . . . . 74.329999999999998 110.23 -176.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -76.45 169.75 17.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.905 -0.589 . . . . 72.319999999999993 110.649 -176.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 4.7 t -57.75 150.97 18.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.155 0.502 . . . . 55.509999999999998 111.898 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -85.19 7.21 22.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.862 -0.608 . . . . 72.120000000000005 111.123 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 500' ' ' LYS . . . . . 0.485 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 54.3 tptt -62.06 -37.34 84.63 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.483 0.659 . . . . 75.0 109.337 174.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.519 ' HB2' HG12 ' A' ' 514' ' ' ILE . 8.4 p90 -152.19 131.64 12.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.954 -1.021 . . . . 71.540000000000006 108.681 175.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -139.0 161.51 37.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.096 0.474 . . . . 72.120000000000005 111.755 -175.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -119.0 139.64 51.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.834 -0.621 . . . . 70.349999999999994 110.755 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.427 ' HE2' ' HB3' ' A' ' 504' ' ' LYS . 40.7 mtpt -127.59 149.69 50.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.11 -0.495 . . . . 75.109999999999999 109.921 176.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.456 ' HD3' ' O ' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -106.62 146.9 30.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.2 0.524 . . . . 73.319999999999993 111.478 -176.108 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -147.31 99.07 3.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.361 -0.836 . . . . 63.009999999999998 109.546 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 61.83 -123.65 32.16 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.453 -0.88 . . . . 51.25 111.107 -173.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -96.92 7.34 46.85 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.172 0.51 . . . . 74.430000000000007 110.423 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.621 ' HG2' ' HG3' ' A' ' 476' ' ' GLU . 74.8 mtm180 -95.26 152.29 18.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.044 -0.525 . . . . 60.32 110.032 177.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -136.94 128.25 28.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.966 -0.383 . . . . 50.329999999999998 109.966 -178.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -111.01 123.91 51.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.515 -0.311 . . . . 63.130000000000003 110.198 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.767 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 58.2 tp -110.28 104.47 13.28 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.511 -0.551 . . . . 45.299999999999997 109.511 174.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.432 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.3 mp -101.38 115.55 43.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.239 -0.437 . . . . 73.0 110.515 -175.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.527 ' O ' ' HG3' ' A' ' 470' ' ' ARG . 51.8 mt -97.74 119.42 45.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.898 -0.779 . . . . 75.540000000000006 108.898 173.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -69.1 -39.56 78.9 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.366 -0.379 . . . . 73.230000000000004 110.88 -177.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 516' ' ' GLU . . . . . 0.485 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 41.4 mt-10 -146.83 113.17 5.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.908 -0.587 . . . . 71.120000000000005 109.617 178.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -58.43 143.23 46.08 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 123.517 0.511 . . . . 71.129999999999995 111.385 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 88.0 mtp -123.38 172.9 8.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.102 -0.499 . . . . 64.019999999999996 110.301 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.477 ' O ' HD13 ' A' ' 519' ' ' LEU . 2.6 tm? -60.7 -31.36 70.64 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.956 -0.387 . . . . 65.540000000000006 109.956 177.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -52.44 -28.62 20.76 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.073 -0.512 . . . . 71.129999999999995 111.87 177.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 521' ' ' ASP . . . . . 0.556 ' HA ' ' HE1' ' A' ' 525' ' ' TYR . 42.6 m-20 -68.16 -15.38 63.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.379 -0.373 . . . . 73.030000000000001 111.802 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.52 ' HB2' HG12 ' A' ' 540' ' ' VAL . . . -71.04 -12.86 61.76 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.13 0.49 . . . . 73.150000000000006 110.225 174.062 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -77.66 156.53 44.6 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 111.138 -0.785 . . . . 30.530000000000001 111.138 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -81.79 117.19 21.89 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.189 0.518 . . . . 64.519999999999996 111.044 -176.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 525' ' ' TYR . . . . . 0.556 ' HE1' ' HA ' ' A' ' 521' ' ' ASP . 73.4 m-85 -88.96 133.76 34.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.205 -0.907 . . . . 74.239999999999995 110.667 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -123.59 135.02 53.74 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.081 -0.509 . . . . 73.25 110.36 176.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.434 ' HA ' ' O ' ' A' ' 485' ' ' LYS . 9.4 tt -109.8 111.0 22.17 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.883 -0.784 . . . . 74.129999999999995 108.883 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 42.1 t -109.5 136.31 49.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.29 -0.414 . . . . 71.200000000000003 110.721 -176.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.423 HG22 HG12 ' A' ' 484' ' ' VAL . 82.3 p -118.22 -175.65 2.9 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.69 -0.485 . . . . 73.400000000000006 109.69 175.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 13.7 m -69.18 -9.08 51.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.761 0.315 . . . . 74.310000000000002 110.942 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 531' ' ' GLY . . . . . 0.418 ' HA3' ' H ' ' A' ' 454' ' ' VAL . . . -124.85 -65.97 0.19 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.395 -0.907 . . . . 75.219999999999999 112.896 -177.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -113.52 171.45 13.84 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.676 -0.773 . . . . 61.100000000000001 112.498 -176.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -138.62 130.34 27.78 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.775 0.321 . . . . 71.099999999999994 110.561 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 534' ' ' ALA . . . . . 0.788 ' HB2' HG13 ' A' ' 456' ' ' ILE . . . -109.47 120.97 44.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.209 -0.451 . . . . 72.140000000000001 110.157 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 5.3 tt -109.05 121.2 44.64 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.093 -0.706 . . . . 64.230000000000004 109.093 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.481 ' CB ' ' HB2' ' A' ' 460' ' ' LEU . . . -119.2 132.13 55.91 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.065 0.46 . . . . 73.329999999999998 110.478 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -99.46 108.73 21.26 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.38 0.61 . . . . 73.430000000000007 109.691 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.453 HD23 ' HB3' ' A' ' 521' ' ' ASP . 37.0 tp -97.78 136.1 38.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.331 -0.85 . . . . 75.200000000000003 109.459 -177.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 31.5 mt -113.03 112.36 40.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.84 -0.43 . . . . 63.25 109.84 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.628 HG23 HG23 ' A' ' 465' ' ' VAL . 4.4 p -113.91 133.34 60.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 108.803 -0.814 . . . . 73.25 108.803 176.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -110.21 148.18 32.34 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.107 0.479 . . . . 73.400000000000006 111.407 -176.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.36 146.97 50.1 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.012 -0.994 . . . . 60.109999999999999 110.786 -178.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 543' ' ' LYS . . . . . 0.46 ' HD2' ' HB3' ' A' ' 466' ' ' MET . 55.9 mtpt . . . . . 0 C--O 1.244 0.803 0 CA-C-O 118.629 -0.7 . . . . 72.239999999999995 109.323 175.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.652 0 N-CA-C 111.78 -0.528 . . . . 52.109999999999999 111.78 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 11.4 t -122.65 153.7 39.01 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.786 -0.45 . . . . 70.310000000000002 109.786 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -78.07 69.22 4.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.15 0.5 . . . . 74.099999999999994 110.047 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 17.6 tpt -98.54 117.45 64.61 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 115.681 -0.69 . . . . 71.140000000000001 109.943 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.48 147.19 87.39 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.781 2.321 . . . . 51.43 112.068 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.68 132.35 32.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.991 -0.55 . . . . 74.109999999999999 110.674 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.9 137.26 34.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.922 -0.581 . . . . 73.519999999999996 110.857 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.566 HD13 HG12 ' A' ' 477' ' ' VAL . 32.9 mm -95.43 119.08 43.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.734 -0.666 . . . . 73.340000000000003 109.717 177.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 457' ' ' THR . . . . . 0.783 ' HB ' ' HG3' ' A' ' 476' ' ' GLU . 7.5 m -86.89 -23.54 25.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 73.209999999999994 111.18 -177.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.824 ' HG2' ' HG2' ' A' ' 476' ' ' GLU . 22.5 mmt180 -123.35 117.32 28.04 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.598 -0.274 . . . . 65.329999999999998 111.671 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -83.42 167.12 13.71 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 123.02 2.48 . . . . 75.420000000000002 111.414 173.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -89.49 169.96 10.92 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.617 0.246 . . . . 40.329999999999998 110.87 -178.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -71.18 118.64 14.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.275 -0.42 . . . . 65.209999999999994 110.453 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -93.94 -13.47 27.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.171 -0.468 . . . . 64.019999999999996 111.27 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -89.66 155.32 19.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.136 0.493 . . . . 62.009999999999998 111.131 -173.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 8.0 tt -88.95 133.13 34.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.708 -0.678 . . . . 70.319999999999993 110.352 -173.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 28.7 m -127.49 176.67 6.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 63.210000000000001 111.035 -177.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 26.4 mmt -113.86 152.91 30.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.323 -0.399 . . . . 75.409999999999997 111.272 -176.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 467' ' ' VAL . . . . . 0.408 HG13 ' O ' ' A' ' 517' ' ' ALA . 83.1 t -68.14 144.69 14.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.549 -0.751 . . . . 71.010000000000005 110.787 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.52 -2.26 53.39 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.911 -0.661 . . . . 45.240000000000002 113.973 175.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -114.57 164.34 14.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.471 0.636 . . . . 54.020000000000003 110.475 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 27.2 ttt85 -84.92 132.88 34.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.975 0.417 . . . . 74.540000000000006 111.166 -177.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.494 ' O ' ' HB ' ' A' ' 514' ' ' ILE . 50.5 t -131.67 138.57 52.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.862 -0.608 . . . . 52.420000000000002 109.605 177.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -131.78 139.44 48.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.778 0.323 . . . . 64.219999999999999 110.461 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.461 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 93.5 m-85 -121.27 109.61 15.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.929 -0.578 . . . . 64.409999999999997 110.154 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -106.43 117.09 33.13 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 119.909 -0.716 . . . . 62.420000000000002 109.467 173.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.768 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 7.7 p -122.8 123.41 40.98 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.555 -0.748 . . . . 62.109999999999999 109.974 -178.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.824 ' HG2' ' HG2' ' A' ' 458' ' ' ARG . 13.3 pt-20 -125.42 145.09 50.22 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.909 0.385 . . . . 74.430000000000007 110.239 -177.095 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.566 HG12 HD13 ' A' ' 456' ' ' ILE . 17.9 m -111.49 164.63 7.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.782 -0.645 . . . . 71.319999999999993 109.543 178.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 15.6 t -78.16 -18.0 56.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.728 0.299 . . . . 74.140000000000001 111.214 -178.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 479' ' ' GLU . . . . . 0.41 ' O ' HG23 ' A' ' 477' ' ' VAL . 44.6 tt0 -103.31 131.94 49.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.817 0.341 . . . . 72.140000000000001 110.422 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 480' ' ' GLU . . . . . 0.517 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 43.2 tt0 -89.17 131.56 35.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.854 0.359 . . . . 60.509999999999998 110.164 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 98.78 -1.42 58.14 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.801 -0.714 . . . . 54.130000000000003 111.523 -176.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.536 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -79.57 112.01 16.41 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.055 0.455 . . . . 74.329999999999998 110.625 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -81.78 147.15 29.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.647 -0.706 . . . . 75.25 110.805 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 28.9 m -126.96 153.24 35.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.006 -0.543 . . . . 65.5 110.459 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -119.23 145.72 45.82 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.644 -0.502 . . . . 71.230000000000004 109.644 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -98.6 129.37 45.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.305 0.574 . . . . 74.510000000000005 110.909 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 487' ' ' LEU . . . . . 0.648 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 2.6 tm? -116.24 131.73 56.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.277 -0.874 . . . . 75.329999999999998 108.846 -177.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.437 ' HE3' ' HA3' ' A' ' 523' ' ' GLY . 1.2 tmtp? -120.55 107.32 12.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.898 0.38 . . . . 70.010000000000005 111.446 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 53.72 37.72 26.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.379 -0.828 . . . . 62.240000000000002 111.993 172.062 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.99 -24.04 33.01 Favored Glycine 0 CA--C 1.517 0.196 0 C-N-CA 120.751 -0.738 . . . . 63.140000000000001 112.553 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.9 t -97.28 127.87 49.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.725 0.298 . . . . 44.32 110.417 -178.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -86.65 131.85 34.04 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.82 -0.437 . . . . 63.200000000000003 109.82 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 3.3 pp -112.14 162.96 14.86 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.072 0.463 . . . . 51.140000000000001 111.256 -177.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 22.2 p -108.19 173.91 6.11 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.906 -0.588 . . . . 61.219999999999999 109.701 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 495' ' ' ARG . . . . . 0.639 ' HD3' ' CE2' ' A' ' 503' ' ' PHE . 13.9 tpt180 -80.9 -4.41 54.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.077 0.465 . . . . 63.329999999999998 110.467 -178.229 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -74.07 75.69 1.74 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.193 0.52 . . . . 73.530000000000001 110.48 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -145.47 170.7 15.87 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.824 -0.625 . . . . 74.409999999999997 109.482 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.436 HG23 ' H ' ' A' ' 500' ' ' LYS . 15.2 t -68.65 172.12 6.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.086 0.47 . . . . 63.32 111.235 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -84.7 18.53 2.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 75.450000000000003 111.931 -172.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 500' ' ' LYS . . . . . 0.436 ' H ' HG23 ' A' ' 498' ' ' THR . 13.8 tmtt? -58.09 -32.43 68.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.464 0.649 . . . . 72.109999999999999 109.785 174.277 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.621 ' HD2' HD11 ' A' ' 512' ' ' LEU . 23.0 p90 -144.44 144.11 31.23 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.467 -0.788 . . . . 65.549999999999997 109.153 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 22.2 p-90 -147.33 145.44 29.33 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.384 -0.371 . . . . 72.349999999999994 110.001 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 503' ' ' PHE . . . . . 0.639 ' CE2' ' HD3' ' A' ' 495' ' ' ARG . 44.9 p90 -126.87 151.99 47.64 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.327 -0.549 . . . . 63.549999999999997 111.651 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.539 ' NZ ' ' HB3' ' A' ' 504' ' ' LYS . 8.9 mtpm? -116.23 150.11 38.07 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.344 -0.844 . . . . 73.340000000000003 110.785 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 505' ' ' LYS . 18.5 ptpt -110.62 106.93 16.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.283 0.563 . . . . 74.540000000000006 109.804 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 506' ' ' ASP . . . . . 0.584 ' HB2' ' HG3' ' A' ' 509' ' ' ARG . 5.5 m-20 -113.82 80.3 1.36 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.23 0.538 . . . . 73.510000000000005 109.883 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.73 -96.7 0.38 Allowed Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.579 -0.737 . . . . 52.25 112.495 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.517 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 19.2 pt20 -108.09 -10.83 15.39 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.918 0.39 . . . . 73.340000000000003 111.365 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.584 ' HG3' ' HB2' ' A' ' 506' ' ' ASP . 5.2 ptp180 -102.74 136.3 42.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.112 0.482 . . . . 74.25 110.528 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 -120.51 122.26 40.24 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.345 -0.613 . . . . 72.209999999999994 109.345 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 511' ' ' HIS . . . . . 0.501 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 12.8 m-70 -109.95 121.64 45.72 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 121.141 -0.223 . . . . 72.200000000000003 110.604 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.621 HD11 ' HD2' ' A' ' 501' ' ' TYR . 67.9 tp -106.93 110.62 22.82 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.45 -0.574 . . . . 74.510000000000005 109.45 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.413 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.1 mp -100.84 119.85 49.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.238 -0.437 . . . . 75.519999999999996 110.145 -178.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.494 ' HB ' ' O ' ' A' ' 471' ' ' VAL . 69.0 mt -106.91 121.27 59.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.395 -0.594 . . . . 74.439999999999998 109.395 174.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -64.96 -51.65 60.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.172 -0.467 . . . . 74.030000000000001 110.227 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 516' ' ' GLU . . . . . 0.432 ' O ' ' HE2' ' A' ' 500' ' ' LYS . 42.0 mt-10 -139.39 129.7 25.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.986 -0.552 . . . . 75.439999999999998 110.157 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.408 ' O ' HG13 ' A' ' 467' ' ' VAL . . . -64.04 132.44 50.57 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.966 -0.383 . . . . 71.109999999999999 109.966 175.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 49.7 ttm -128.6 171.85 11.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.926 -0.579 . . . . 60.409999999999997 109.625 -174.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 9.4 mp -54.87 -31.77 60.07 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.188 0.44 . . . . 62.229999999999997 112.188 -178.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -65.33 -21.45 66.7 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.485 0.55 . . . . 75.439999999999998 112.485 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -75.39 -14.56 60.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.888 0.375 . . . . 72.310000000000002 110.938 -178.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.431 ' HA ' ' H ' ' A' ' 540' ' ' VAL . . . -64.4 -20.97 66.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.2 -0.455 . . . . 50.25 109.935 173.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 523' ' ' GLY . . . . . 0.437 ' HA3' ' HE3' ' A' ' 488' ' ' LYS . . . -66.06 120.65 16.65 Favored Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 110.825 -0.91 . . . . 51.340000000000003 110.825 173.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -64.09 106.93 1.15 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.089 0.471 . . . . 64.329999999999998 110.956 -172.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 525' ' ' TYR . . . . . 0.416 ' HA ' ' O ' ' A' ' 487' ' ' LEU . 96.9 m-85 -75.09 135.03 41.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.416 -0.811 . . . . 73.120000000000005 111.459 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.648 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -126.07 139.57 53.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.559 -0.746 . . . . 75.150000000000006 109.678 175.495 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 37.5 tp -97.97 107.1 19.51 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.894 -0.409 . . . . 64.109999999999999 109.894 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 53.2 m -91.7 114.01 26.43 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.17 -0.468 . . . . 71.420000000000002 110.368 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 3.2 m -119.2 163.4 17.14 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.872 -0.604 . . . . 64.239999999999995 109.915 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 26.0 t -72.64 -5.29 36.42 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 111.769 0.285 . . . . 64.439999999999998 111.769 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -119.83 -105.7 2.11 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.562 -0.828 . . . . 75.25 111.701 177.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -91.02 124.24 7.47 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.902 -0.879 . . . . 62.32 110.902 174.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -94.13 141.57 28.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.952 0.406 . . . . 70.439999999999998 110.241 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -103.62 125.11 49.93 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.115 -0.493 . . . . 74.120000000000005 110.365 -178.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 5.2 tt -128.34 121.43 29.15 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.25 0.548 . . . . 74.230000000000004 110.294 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -135.0 141.26 46.17 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.458 -0.942 . . . . 74.420000000000002 108.458 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -96.43 109.7 22.19 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.044 0.926 . . . . 75.340000000000003 110.543 -174.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 54.8 tp -95.76 136.75 35.78 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.641 -1.163 . . . . 51.219999999999999 109.733 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 55.8 mt -126.08 118.87 52.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.992 -0.549 . . . . 72.310000000000002 109.649 177.307 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.431 ' H ' ' HA ' ' A' ' 522' ' ' ALA . 40.9 t -114.44 105.41 18.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 109.699 -0.482 . . . . 65.439999999999998 109.699 179.323 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -87.36 139.29 30.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.852 -0.613 . . . . 75.310000000000002 110.864 -176.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 542' ' ' GLU . . . . . 0.41 ' H ' ' CD ' ' A' ' 542' ' ' GLU . 1.0 OUTLIER -86.47 155.99 20.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.456 -0.793 . . . . 63.009999999999998 110.679 -178.65 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 543' ' ' LYS . . . . . 0.401 ' HB3' ' HE3' ' A' ' 543' ' ' LYS . 26.3 mtpp . . . . . 0 C--O 1.248 1.011 0 CA-C-N 115.904 -0.589 . . . . 73.540000000000006 109.673 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.81 0 N-CA-C 111.786 -0.526 . . . . 64.310000000000002 111.786 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 3.1 p -139.09 141.89 38.13 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.114 -0.328 . . . . 74.219999999999999 110.114 177.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 -77.82 92.07 4.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.156 0.503 . . . . 70.209999999999994 110.311 -178.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 24.3 mmt -116.91 157.34 46.65 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 115.473 -0.785 . . . . 61.43 110.013 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 453' ' ' PRO . . . . . 0.463 ' O ' HD22 ' A' ' 455' ' ' LEU . 35.1 Cg_exo -62.07 164.36 17.15 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.596 2.198 . . . . 73.519999999999996 110.931 172.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 56.5 t -65.98 113.32 2.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.932 -0.307 . . . . 71.400000000000006 110.341 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 455' ' ' LEU . . . . . 0.463 HD22 ' O ' ' A' ' 453' ' ' PRO . 2.6 mm? -78.62 125.22 29.07 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.113 -0.494 . . . . 70.230000000000004 111.084 -176.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 36.5 mm -81.96 106.34 12.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.064 -0.717 . . . . 64.340000000000003 109.064 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 86.1 m -62.02 -39.54 92.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.105 -0.498 . . . . 74.329999999999998 111.491 -175.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 458' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -128.63 121.84 21.36 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.445 -0.343 . . . . 64.140000000000001 110.532 -179.104 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.49 167.88 23.64 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.932 2.422 . . . . 70.400000000000006 112.398 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 460' ' ' LEU . . . . . 0.482 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 97.0 mt -80.89 147.38 30.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 74.439999999999998 110.586 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -55.67 122.25 10.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.451 -0.795 . . . . 63.439999999999998 111.721 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -93.18 -11.09 33.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.238 -0.892 . . . . 63.399999999999999 112.054 -176.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -88.05 157.42 18.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.473 0.654 . . . . 74.109999999999999 111.882 -169.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 9.0 tt -86.84 142.3 28.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.016 -0.993 . . . . 72.030000000000001 110.534 -173.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 27.7 m -130.18 178.17 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 CA-C-N 115.936 -0.575 . . . . 72.5 110.823 -178.038 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 21.0 ptp -127.24 160.28 31.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.965 0.412 . . . . 75.329999999999998 111.531 -178.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.63 146.25 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.188 -0.914 . . . . 62.420000000000002 112.45 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 102.02 -7.79 55.2 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 121.084 -0.579 . . . . 45.130000000000003 114.136 171.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -112.51 167.71 10.23 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 122.268 -0.548 . . . . 64.549999999999997 110.323 178.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.98 141.34 29.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.976 -0.749 . . . . 65.310000000000002 108.976 176.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.731 HG23 ' HB ' ' A' ' 514' ' ' ILE . 6.8 m -127.96 123.38 60.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 121.294 0.569 . . . . 54.009999999999998 110.01 176.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -121.93 123.96 42.94 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.303 0.573 . . . . 73.150000000000006 110.577 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -114.06 132.67 55.94 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.234 -0.894 . . . . 75.109999999999999 109.615 -175.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -120.32 116.91 26.47 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.46 -0.496 . . . . 73.120000000000005 110.669 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.666 ' O ' ' HB2' ' A' ' 510' ' ' HIS . 5.9 p -139.26 110.95 7.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.726 -0.67 . . . . 54.409999999999997 109.974 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.602 ' HB3' ' H ' ' A' ' 510' ' ' HIS . 0.6 OUTLIER -128.92 163.27 25.66 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.238 -0.437 . . . . 73.439999999999998 110.343 -178.644 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.513 HG21 ' HB3' ' A' ' 482' ' ' ALA . 17.7 m -113.67 171.91 3.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.25 -0.432 . . . . 72.209999999999994 110.874 -173.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 20.2 t -88.79 -22.28 23.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.043 -0.526 . . . . 70.450000000000003 110.854 -177.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -96.75 132.51 42.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.632 -0.507 . . . . 75.239999999999995 109.632 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 480' ' ' GLU . . . . . 0.651 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 11.4 pt-20 -87.47 137.54 32.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.108 0.48 . . . . 74.310000000000002 111.012 -175.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 95.58 -6.97 68.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.831 -0.699 . . . . 55.299999999999997 111.959 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.513 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -77.97 110.71 13.14 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.121 0.486 . . . . 74.299999999999997 110.187 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -92.8 164.88 13.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.822 -0.626 . . . . 62.420000000000002 110.508 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.489 HG12 HG23 ' A' ' 529' ' ' THR . 35.5 m -135.95 154.82 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.208 -0.451 . . . . 71.310000000000002 110.345 -178.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -117.42 138.71 51.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.769 -0.456 . . . . 74.5 109.769 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 486' ' ' TRP . . . . . 0.587 ' HB2' HD21 ' A' ' 493' ' ' LEU . 87.6 m95 -99.34 138.12 36.87 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.045 0.45 . . . . 72.0 111.217 -176.059 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 487' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 34.5 tp -121.84 128.99 52.27 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.259 -0.645 . . . . 72.140000000000001 109.259 176.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -112.36 106.68 15.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.004 0.431 . . . . 70.019999999999996 110.909 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.1 t70 53.63 36.82 24.56 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.447 -0.797 . . . . 73.340000000000003 111.625 174.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 94.15 -21.02 44.49 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.771 -0.728 . . . . 62.399999999999999 112.669 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 61.6 t -99.77 133.07 43.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 110.099 -0.334 . . . . 74.319999999999993 110.099 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -78.81 125.61 29.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.868 -0.79 . . . . 63.119999999999997 108.868 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.587 HD21 ' HB2' ' A' ' 486' ' ' TRP . 3.2 pp -68.73 161.82 27.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.382 0.61 . . . . 71.420000000000002 112.098 -170.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 6.6 t -107.4 172.88 6.58 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.126 -0.943 . . . . 52.530000000000001 110.903 -172.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -104.64 7.62 35.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.224 0.535 . . . . 75.109999999999999 110.274 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -62.11 -69.44 0.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.876 -0.602 . . . . 71.120000000000005 111.417 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 497' ' ' GLU . . . . . 0.538 ' OE2' ' HB2' ' A' ' 500' ' ' LYS . 25.7 tt0 -106.68 118.89 37.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.116 0.484 . . . . 72.319999999999993 110.477 178.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.605 HG22 ' HB3' ' A' ' 502' ' ' TRP . 3.9 m -111.27 11.69 21.7 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.629 0.728 . . . . 71.430000000000007 109.686 175.131 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 499' ' ' PHE . . . . . 0.502 ' H ' ' HG2' ' A' ' 497' ' ' GLU . 89.3 m-85 -83.81 -25.51 30.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.639 -0.71 . . . . 72.340000000000003 111.249 -176.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 500' ' ' LYS . . . . . 0.538 ' HB2' ' OE2' ' A' ' 497' ' ' GLU . 4.6 ttmp? -69.69 -42.43 74.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.113 0.483 . . . . 72.439999999999998 110.017 177.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.505 ' HB2' HG12 ' A' ' 514' ' ' ILE . 7.5 p90 -159.0 142.2 14.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.499 -0.773 . . . . 63.340000000000003 110.164 -178.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 502' ' ' TRP . . . . . 0.605 ' HB3' HG22 ' A' ' 498' ' ' THR . 0.1 OUTLIER -140.78 145.59 36.55 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.201 -0.454 . . . . 74.329999999999998 110.991 178.478 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 503' ' ' PHE . . . . . 0.472 ' HB3' HD13 ' A' ' 512' ' ' LEU . 31.2 p90 -117.77 151.69 36.8 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.21 -0.45 . . . . 74.25 109.925 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -115.52 135.44 54.09 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.981 -0.554 . . . . 73.140000000000001 109.787 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 1.9 pptp? -104.49 132.71 50.42 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.856 -0.424 . . . . 72.519999999999996 109.856 172.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 506' ' ' ASP . . . . . 0.686 ' HB3' ' HB2' ' A' ' 509' ' ' ARG . 8.0 t70 -143.2 84.38 1.82 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.168 -0.469 . . . . 73.310000000000002 109.865 -177.017 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.31 -97.61 0.34 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.032 -0.604 . . . . 74.150000000000006 111.854 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.651 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 19.1 pt20 -105.55 -7.69 18.46 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.328 0.585 . . . . 73.239999999999995 110.315 176.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.686 ' HB2' ' HB3' ' A' ' 506' ' ' ASP . 58.2 mtt180 -84.66 139.87 31.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.415 -0.811 . . . . 73.409999999999997 110.807 -175.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 510' ' ' HIS . . . . . 0.666 ' HB2' ' O ' ' A' ' 475' ' ' CYS . 95.2 m-70 -141.77 116.99 10.07 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.414 -0.587 . . . . 73.140000000000001 109.414 174.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 19.8 m-70 -125.75 122.88 37.5 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.93 -0.396 . . . . 75.349999999999994 109.93 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 503' ' ' PHE . 54.0 tp -107.39 120.14 41.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.861 0.362 . . . . 54.43 110.513 -176.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 60.5 mt -115.06 114.51 46.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 116.504 -0.316 . . . . 52.450000000000003 110.556 -178.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.731 ' HB ' HG23 ' A' ' 471' ' ' VAL . 58.5 mt -100.59 119.86 49.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.196 0.522 . . . . 71.200000000000003 109.598 176.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -70.75 -37.71 73.44 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.359 -0.837 . . . . 64.450000000000003 111.935 -173.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -138.63 111.07 7.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.598 -0.274 . . . . 74.319999999999993 111.296 -177.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -67.29 122.35 17.69 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.679 -0.489 . . . . 64.430000000000007 109.679 173.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 93.9 mmm -135.04 175.21 9.79 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.886 -0.597 . . . . 74.219999999999999 110.548 -174.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.83 -33.76 74.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.858 0.361 . . . . 72.400000000000006 110.77 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -62.85 -26.56 68.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.224 0.535 . . . . 73.230000000000004 111.071 173.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -83.2 -14.89 52.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.423 -0.808 . . . . 70.319999999999993 110.151 -177.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -76.31 5.61 6.79 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.795 -0.638 . . . . 52.210000000000001 111.202 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -70.64 158.14 53.61 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.908 -0.663 . . . . 64.209999999999994 111.607 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -83.3 114.16 21.21 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 122.048 -0.678 . . . . 72.099999999999994 109.999 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -88.37 132.97 34.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.149 0.5 . . . . 61.539999999999999 111.503 -174.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.615 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -122.69 142.92 50.16 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.607 -0.724 . . . . 72.030000000000001 109.702 175.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.713 ' HB3' ' HB3' ' A' ' 534' ' ' ALA . 10.0 tt -121.13 117.92 28.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.986 0.422 . . . . 44.049999999999997 109.999 -176.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 55.9 m -99.23 124.02 43.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.01 -0.541 . . . . 72.209999999999994 110.482 -179.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.503 ' HB ' ' H ' ' A' ' 532' ' ' GLY . 2.3 m -113.78 166.13 11.86 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.168 -0.308 . . . . 74.439999999999998 110.168 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 9.5 m -54.83 -36.32 64.89 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.807 0.337 . . . . 70.420000000000002 111.83 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -136.43 -6.77 1.79 Allowed Glycine 0 C--O 1.227 -0.304 0 C-N-CA 120.476 -0.869 . . . . 74.329999999999998 112.716 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 532' ' ' GLY . . . . . 0.503 ' H ' ' HB ' ' A' ' 529' ' ' THR . . . -115.34 173.27 14.64 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.828 -0.701 . . . . 52.549999999999997 112.266 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -146.68 137.63 24.08 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.917 -0.401 . . . . 72.439999999999998 109.917 177.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 534' ' ' ALA . . . . . 0.713 ' HB3' ' HB3' ' A' ' 527' ' ' LEU . . . -132.65 148.55 52.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.405 -0.361 . . . . 62.450000000000003 110.501 178.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 7.7 tt -144.62 131.28 20.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.609 -0.886 . . . . 63.520000000000003 108.609 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 536' ' ' ALA . . . . . 0.482 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -135.13 137.44 42.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.157 0.503 . . . . 51.310000000000002 110.757 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -99.68 109.09 21.58 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.994 -0.548 . . . . 75.030000000000001 109.846 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 52.7 tp -104.23 115.87 31.18 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.731 -0.668 . . . . 54.329999999999998 109.792 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.436 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 54.6 mt -105.65 112.37 38.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 109.769 -0.456 . . . . 74.239999999999995 109.769 177.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 36.3 t -102.97 102.37 13.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 116.043 -0.526 . . . . 71.510000000000005 109.75 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -85.36 145.74 27.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.029 -0.532 . . . . 73.420000000000002 111.145 -176.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -81.05 153.77 27.2 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.313 -0.625 . . . . 74.200000000000003 109.313 172.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.337 -0.839 . . . . 53.310000000000002 110.085 -178.099 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.684 0 N-CA-C 111.856 -0.498 . . . . 62.109999999999999 111.856 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 69.1 m -136.04 148.31 48.3 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.898 0.38 . . . . 74.099999999999994 110.958 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 15.7 m170 -68.6 129.79 40.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.92 -0.582 . . . . 65.010000000000005 110.504 177.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 20.2 ptp -70.81 152.58 95.09 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.965 -0.562 . . . . 73.340000000000003 110.064 177.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.64 150.63 87.88 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.44 2.093 . . . . 52.5 111.701 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.69 114.72 3.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.199 -0.455 . . . . 63.420000000000002 110.275 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 93.4 mt -78.98 142.95 36.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.856 -0.611 . . . . 71.219999999999999 110.995 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.414 HD13 HG12 ' A' ' 477' ' ' VAL . 31.0 mm -96.84 119.24 44.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.617 -0.72 . . . . 40.32 109.93 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 31.6 p -92.45 -31.7 15.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.022 0.439 . . . . 74.310000000000002 111.597 -178.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.753 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 18.5 mmt180 -101.18 121.63 51.28 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.284 -0.417 . . . . 74.5 110.638 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -86.78 161.27 9.11 Favored 'Trans proline' 0 N--CA 1.45 -1.049 0 C-N-CA 122.077 1.851 . . . . 64.439999999999998 112.176 175.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -83.3 172.32 12.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.008 -0.542 . . . . 42.340000000000003 110.062 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 461' ' ' GLU . . . . . 0.868 ' HG3' HD13 ' A' ' 538' ' ' LEU . 4.7 pm0 -56.99 118.21 4.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.818 0.818 . . . . 73.140000000000001 112.856 -172.612 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -95.28 -19.1 20.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.48 -0.782 . . . . 73.329999999999998 110.302 172.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -92.16 154.72 18.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 75.230000000000004 111.605 -174.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.705 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 3.2 tt -90.12 134.86 34.01 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.021 -0.733 . . . . 73.030000000000001 109.021 176.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.483 ' N ' HD23 ' A' ' 464' ' ' LEU . 35.8 m -120.8 160.98 21.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.176 0.513 . . . . 73.409999999999997 111.778 -174.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 466' ' ' MET . . . . . 0.441 ' SD ' ' HD3' ' A' ' 543' ' ' LYS . 23.1 ptp -98.85 153.37 18.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 74.109999999999999 110.582 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 467' ' ' VAL . . . . . 0.46 ' CG1' ' HA ' ' A' ' 542' ' ' GLU . 14.3 p -69.01 145.21 13.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 72.25 111.246 177.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 100.5 -24.74 30.92 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.778 -0.725 . . . . 44.210000000000001 113.7 172.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -85.81 162.0 18.86 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 117.191 0.496 . . . . 71.010000000000005 110.916 -177.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -86.27 116.8 24.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.962 -0.563 . . . . 70.430000000000007 109.778 176.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 22.0 t -117.23 126.74 74.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 110.037 -0.357 . . . . 52.549999999999997 110.037 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.505 ' HG2' HG23 ' A' ' 513' ' ' ILE . 41.2 mt-10 -109.07 123.47 49.22 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.447 -0.342 . . . . 74.030000000000001 110.201 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.591 ' CE1' ' HB3' ' A' ' 461' ' ' GLU . 25.3 m-85 -106.85 109.08 20.89 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.415 -0.587 . . . . 71.349999999999994 109.415 177.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 474' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' A' ' 458' ' ' ARG . 29.5 mt-10 -106.58 116.73 32.44 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.701 -0.481 . . . . 64.230000000000004 109.701 -178.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.753 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 36.8 t -135.69 111.81 9.65 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.227 0.537 . . . . 73.519999999999996 110.07 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.627 ' HB3' ' H ' ' A' ' 510' ' ' HIS . 7.3 pt-20 -131.05 167.67 18.69 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.776 -0.647 . . . . 72.530000000000001 109.897 -176.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.663 HG21 ' HB3' ' A' ' 482' ' ' ALA . 20.9 m -115.06 166.94 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.932 0.396 . . . . 75.129999999999995 111.59 -172.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 41.2 t -86.34 -11.08 53.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.73 -0.668 . . . . 73.109999999999999 111.695 -176.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -116.22 139.72 50.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.903 0.382 . . . . 71.010000000000005 111.208 -175.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' GLU . . . . . 0.637 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 7.7 tp10 -75.49 146.83 40.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.65 -0.705 . . . . 72.099999999999994 110.79 -177.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 82.43 -8.76 60.58 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 116.018 -0.537 . . . . 73.040000000000006 112.977 177.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.663 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -74.72 116.26 15.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.418 0.627 . . . . 71.200000000000003 111.484 -176.244 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -82.31 156.05 24.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.115 -0.948 . . . . 72.120000000000005 110.327 178.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 26.8 m -129.27 154.36 40.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.322 -0.399 . . . . 73.409999999999997 110.726 -178.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 485' ' ' LYS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 57.3 tttp -118.49 134.93 54.69 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.871 -0.604 . . . . 63.43 110.076 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -98.23 122.06 40.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.069 0.461 . . . . 64.319999999999993 110.582 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 24.4 tp -120.12 125.35 48.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.654 -0.703 . . . . 64.519999999999996 109.53 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.552 ' HD2' HD21 ' A' ' 493' ' ' LEU . 26.1 tttp -101.65 103.65 14.46 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.762 -0.458 . . . . 64.230000000000004 109.762 -177.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.6 t0 45.81 38.23 4.16 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.781 0.832 . . . . 73.329999999999998 112.518 -179.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 93.02 -4.75 75.17 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.542 -0.837 . . . . 54.229999999999997 112.711 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 54.3 t -99.85 127.32 52.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.947 -0.39 . . . . 54.140000000000001 109.947 176.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -72.95 124.56 25.69 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.066 -0.515 . . . . 62.210000000000001 110.598 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.552 HD21 ' HD2' ' A' ' 488' ' ' LYS . 86.0 mt -76.49 148.54 37.11 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.135 -0.484 . . . . 63.009999999999998 110.787 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 7.8 t -93.48 165.47 12.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.901 -0.59 . . . . 73.510000000000005 110.771 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -65.61 -29.07 69.61 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.061 0.458 . . . . 73.510000000000005 110.677 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -108.77 80.77 1.37 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.3 0.572 . . . . 74.239999999999995 110.506 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -96.52 161.32 13.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.354 -0.839 . . . . 73.519999999999996 109.888 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 11.2 t -63.29 151.86 39.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.058 0.456 . . . . 62.299999999999997 110.962 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -85.23 16.97 3.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.098 -0.501 . . . . 72.109999999999999 111.12 -176.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 500' ' ' LYS . . . . . 0.7 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 33.3 tttp -71.66 -28.06 63.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.482 -0.562 . . . . 74.340000000000003 109.482 177.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.554 ' HB3' HG23 ' A' ' 514' ' ' ILE . 2.2 p90 -142.82 135.01 27.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.661 -0.7 . . . . 73.310000000000002 110.101 173.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 502' ' ' TRP . . . . . 0.488 ' CZ3' ' HE3' ' A' ' 504' ' ' LYS . 11.4 p-90 -139.17 166.51 24.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.513 -0.767 . . . . 75.019999999999996 109.705 -172.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -133.58 157.46 45.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.438 0.637 . . . . 64.25 112.403 -175.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.488 ' HE3' ' CZ3' ' A' ' 502' ' ' TRP . 99.7 mttt -118.21 150.73 38.93 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.549 -1.205 . . . . 73.329999999999998 108.913 174.564 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.4 pptp? -137.94 129.87 28.59 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.348 0.594 . . . . 72.340000000000003 111.208 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' ASP . . . . . 0.652 ' HB2' ' HB2' ' A' ' 509' ' ' ARG . 26.9 m-20 -119.56 79.5 1.44 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.58 -0.896 . . . . 50.310000000000002 108.58 173.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 60.33 -104.44 0.62 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.92 -0.657 . . . . 74.530000000000001 112.402 -175.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.637 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 20.7 pt20 -80.39 -16.38 54.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.995 0.426 . . . . 75.120000000000005 110.734 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.652 ' HB2' ' HB2' ' A' ' 506' ' ' ASP . 84.8 mtt180 -84.71 132.02 34.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.126 -0.488 . . . . 63.539999999999999 110.12 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 510' ' ' HIS . . . . . 0.627 ' H ' ' HB3' ' A' ' 476' ' ' GLU . 77.9 m-70 -136.14 117.11 14.25 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.38 -0.6 . . . . 72.349999999999994 109.38 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -125.63 121.71 34.32 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 121.034 -0.266 . . . . 62.409999999999997 110.498 -175.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 512' ' ' LEU . . . . . 0.409 ' HB3' ' O ' ' A' ' 473' ' ' PHE . 37.7 tp -103.61 133.11 49.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.717 0.294 . . . . 61.329999999999998 110.435 -178.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.505 HG23 ' HG2' ' A' ' 472' ' ' GLU . 4.7 mp -121.19 116.85 50.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 110.083 -0.34 . . . . 60.119999999999997 110.083 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.554 HG23 ' HB3' ' A' ' 501' ' ' TYR . 46.9 mt -97.49 120.56 46.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.399 -0.593 . . . . 75.409999999999997 109.399 175.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -69.06 -41.06 78.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.006 0.432 . . . . 75.150000000000006 110.483 -177.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 516' ' ' GLU . . . . . 0.7 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 34.2 mt-10 -137.47 107.95 6.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.94 -0.573 . . . . 73.420000000000002 110.407 -178.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -65.26 122.59 17.46 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.264 -0.643 . . . . 52.229999999999997 109.264 174.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 518' ' ' MET . . . . . 0.497 ' HG3' ' HG2' ' A' ' 520' ' ' GLU . 11.9 tpt -125.83 157.1 38.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.667 0.27 . . . . 75.430000000000007 110.858 -172.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.93 -38.14 84.76 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.231 -0.441 . . . . 73.230000000000004 111.397 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 520' ' ' GLU . . . . . 0.497 ' HG2' ' HG3' ' A' ' 518' ' ' MET . 10.4 pt-20 -70.15 -22.35 62.99 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.222 0.534 . . . . 75.299999999999997 110.832 178.031 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -88.09 -13.29 41.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.707 -0.679 . . . . 73.430000000000007 110.392 -176.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.524 ' HB2' ' HB ' ' A' ' 540' ' ' VAL . . . -63.0 6.19 0.11 Allowed 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.723 1.009 . . . . 74.239999999999995 113.723 -174.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -59.67 137.03 50.01 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.273 -0.731 . . . . 72.150000000000006 111.273 175.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -60.94 126.48 27.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.356 -0.238 . . . . 52.25 110.356 -175.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -84.95 131.15 34.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.83 0.824 . . . . 73.25 112.19 -174.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.1 135.79 48.62 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.765 -1.107 . . . . 52.329999999999998 109.837 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 9.9 tt -122.32 122.99 40.36 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.68 -0.489 . . . . 61.310000000000002 109.68 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 528' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 57.6 m -103.61 124.55 49.02 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.983 -0.553 . . . . 75.519999999999996 110.598 -177.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.478 HG21 HG11 ' A' ' 477' ' ' VAL . 14.3 m -117.56 166.59 12.2 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.344 -0.613 . . . . 73.129999999999995 109.344 176.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 530' ' ' SER . . . . . 0.429 ' N ' HG22 ' A' ' 529' ' ' THR . 22.9 t -66.68 -11.24 53.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.82 0.343 . . . . 72.140000000000001 110.699 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -99.52 -83.6 1.74 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.0 -0.619 . . . . 71.439999999999998 112.05 177.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -114.02 166.96 12.2 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.7 -0.762 . . . . 63.229999999999997 112.24 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -109.92 122.71 48.18 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.802 -0.444 . . . . 62.439999999999998 109.802 177.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -103.2 135.12 45.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.46 -0.336 . . . . 44.240000000000002 110.431 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 8.3 tt -146.05 136.69 24.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.892 -0.41 . . . . 63.229999999999997 109.892 -178.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -143.5 155.27 44.29 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.278 -0.419 . . . . 72.439999999999998 109.945 178.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -96.54 112.06 23.95 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.4 0.619 . . . . 64.430000000000007 111.225 -177.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.868 HD13 ' HG3' ' A' ' 461' ' ' GLU . 62.8 tp -94.52 136.45 34.81 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.668 -0.697 . . . . 64.200000000000003 110.115 177.132 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.705 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 65.3 mt -133.15 134.03 57.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.848 -0.797 . . . . 75.010000000000005 108.848 175.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.524 ' HB ' ' HB2' ' A' ' 522' ' ' ALA . 98.4 t -122.84 116.28 48.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 110.021 -0.362 . . . . 70.209999999999994 110.021 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 541' ' ' GLN . . . . . 0.635 ' HG3' HD21 ' A' ' 464' ' ' LEU . 50.4 mt-30 -94.34 140.58 29.62 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.25 -0.432 . . . . 74.200000000000003 110.758 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 542' ' ' GLU . . . . . 0.46 ' HA ' ' CG1' ' A' ' 467' ' ' VAL . 41.9 tt0 -75.0 141.26 43.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.534 -0.757 . . . . 64.209999999999994 109.541 175.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 543' ' ' LYS . . . . . 0.441 ' HD3' ' SD ' ' A' ' 466' ' ' MET . 54.4 mtmt . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.13 -0.938 . . . . 74.219999999999999 109.512 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 112.416 -0.274 . . . . 53.32 112.416 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 31.3 m -73.17 129.5 38.19 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.856 0.36 . . . . 50.420000000000002 111.388 -177.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -108.95 178.54 4.44 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.068 -0.715 . . . . 73.430000000000007 109.068 172.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 57.2 mtm -113.94 99.07 49.6 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-O 120.903 0.382 . . . . 71.329999999999998 110.628 179.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -72.23 135.76 25.45 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.073 1.849 . . . . 73.230000000000004 111.424 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 454' ' ' VAL . . . . . 0.438 HG12 ' HB ' ' A' ' 477' ' ' VAL . 19.6 t -74.9 111.26 10.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.59 -0.522 . . . . 72.019999999999996 109.59 178.064 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 90.6 mt -97.6 164.06 12.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.924 -0.58 . . . . 73.219999999999999 110.901 -175.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 456' ' ' ILE . . . . . 0.473 HD13 HG12 ' A' ' 477' ' ' VAL . 48.4 mm -96.87 115.06 35.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.838 -0.619 . . . . 63.450000000000003 110.193 -178.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 33.7 m -85.69 -35.61 20.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.145 0.498 . . . . 65.409999999999997 110.823 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 458' ' ' ARG . . . . . 0.839 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 5.7 mmp_? -108.52 108.14 60.71 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.094 -0.503 . . . . 71.140000000000001 110.362 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_exo -70.78 155.63 62.21 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.405 2.07 . . . . 72.200000000000003 111.436 176.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.11 162.7 23.59 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.774 -0.454 . . . . 74.200000000000003 109.774 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -69.91 121.04 16.56 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.487 0.661 . . . . 61.399999999999999 111.444 -173.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -92.22 -11.65 34.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.993 -1.003 . . . . 73.510000000000005 111.711 -176.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -87.56 156.01 19.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.127 0.489 . . . . 71.340000000000003 110.925 -170.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.659 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 6.0 tt -88.55 136.61 32.9 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.363 -0.835 . . . . 74.150000000000006 109.679 -171.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 465' ' ' VAL . . . . . 0.49 ' N ' HD23 ' A' ' 464' ' ' LEU . 30.6 m -120.97 172.25 8.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.269 0.557 . . . . 70.239999999999995 111.655 -173.142 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 466' ' ' MET . . . . . 0.534 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 66.5 mtt -116.62 163.52 15.98 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.795 -0.639 . . . . 64.310000000000002 109.964 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 467' ' ' VAL . . . . . 0.5 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 48.6 t -65.04 131.02 30.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.338 -0.392 . . . . 72.120000000000005 111.185 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.14 -14.32 58.43 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.818 -0.706 . . . . 74.510000000000005 114.602 171.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 466' ' ' MET . 16.5 pt20 -83.17 149.42 26.86 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.923 0.862 . . . . 64.140000000000001 110.637 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 44.8 ttt180 -73.6 116.1 13.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.524 -0.762 . . . . 71.209999999999994 110.567 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 95.0 t -120.86 123.38 70.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.792 -0.64 . . . . 71.430000000000007 109.859 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -133.92 140.79 47.02 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.185 0.517 . . . . 74.519999999999996 110.172 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.544 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 90.5 m-85 -105.99 124.8 50.15 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.854 -0.612 . . . . 71.519999999999996 110.786 -175.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -97.63 117.73 32.57 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.969 -1.123 . . . . 74.129999999999995 107.969 176.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 475' ' ' CYS . . . . . 0.839 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 6.4 p -140.23 119.04 12.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.184 0.516 . . . . 73.099999999999994 111.699 -175.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.599 ' HG2' ' CG ' ' A' ' 458' ' ' ARG . 10.1 pt-20 -131.05 148.81 52.79 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.005 -0.739 . . . . 73.239999999999995 109.005 175.26 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 477' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 482' ' ' ALA . 18.3 m -111.19 164.38 7.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 116.238 -0.437 . . . . 73.129999999999995 110.859 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 53.5 p -65.67 -25.89 67.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.032 -0.531 . . . . 71.109999999999999 112.403 -174.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -106.87 133.7 51.13 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.912 -0.315 . . . . 70.340000000000003 110.786 -174.158 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 480' ' ' GLU . . . . . 0.665 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 10.0 tp10 -73.36 147.4 44.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.086 -0.506 . . . . 74.430000000000007 110.673 -178.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 61.27 34.45 88.2 Favored Glycine 0 N--CA 1.453 -0.221 0 CA-C-N 115.898 -0.592 . . . . 53.520000000000003 112.82 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.49 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -95.19 154.45 17.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.006 0.432 . . . . 62.310000000000002 111.062 -178.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -100.77 133.11 45.72 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.75 -0.659 . . . . 73.019999999999996 110.647 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' VAL . . . . . 0.519 ' HB ' HD21 ' A' ' 527' ' ' LEU . 32.5 m -124.15 144.24 34.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.931 -0.577 . . . . 70.329999999999998 109.547 175.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -126.96 141.04 51.9 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.751 0.31 . . . . 65.140000000000001 110.292 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -98.3 137.35 37.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.086 -0.507 . . . . 73.439999999999998 111.074 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 55.6 tp -134.21 118.78 18.0 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.747 -0.835 . . . . 74.349999999999994 108.747 173.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 488' ' ' LYS . . . . . 0.455 ' HD3' ' C ' ' A' ' 488' ' ' LYS . 14.1 tmtt? -109.52 106.2 15.83 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.703 -0.399 . . . . 64.219999999999999 110.518 -176.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 2.5 t70 48.66 38.74 12.08 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.333 -0.849 . . . . 72.400000000000006 112.015 173.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.62 -16.01 60.26 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.79 -0.719 . . . . 73.010000000000005 113.001 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 47.4 t -104.72 122.23 57.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.741 0.305 . . . . 72.109999999999999 110.427 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -81.46 133.94 35.47 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.765 -0.457 . . . . 62.020000000000003 109.765 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 69.4 mt -74.99 152.89 38.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.104 -0.498 . . . . 65.329999999999998 111.114 -175.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 494' ' ' THR . . . . . 0.685 HG22 ' H ' ' A' ' 496' ' ' GLU . 4.8 m -91.2 141.51 28.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.029 -0.532 . . . . 63.310000000000002 110.937 -175.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -83.13 -6.2 59.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.23 0.538 . . . . 74.230000000000004 110.539 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 496' ' ' GLU . . . . . 0.685 ' H ' HG22 ' A' ' 494' ' ' THR . 7.6 pt-20 -130.35 34.72 4.15 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.554 -0.748 . . . . 73.200000000000003 109.763 178.338 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 497' ' ' GLU . . . . . 0.569 ' HB2' ' HB ' ' A' ' 494' ' ' THR . 7.1 tp10 -71.93 170.71 13.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.315 -0.857 . . . . 71.420000000000002 110.782 -176.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 498' ' ' THR . . . . . 0.473 HG23 ' H ' ' A' ' 500' ' ' LYS . 8.9 t -68.58 -176.7 0.83 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.119 -0.491 . . . . 74.219999999999999 110.837 175.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -78.99 17.1 0.79 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.456 -0.338 . . . . 71.120000000000005 111.853 -174.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 500' ' ' LYS . . . . . 0.473 ' H ' HG23 ' A' ' 498' ' ' THR . 21.6 tptm -61.87 -45.96 91.48 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.908 -0.775 . . . . 74.439999999999998 108.908 176.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 501' ' ' TYR . . . . . 0.558 ' HB3' HG12 ' A' ' 514' ' ' ILE . 10.1 p90 -143.04 143.39 31.86 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.054 -0.976 . . . . 73.239999999999995 109.52 176.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 35.9 p-90 -135.91 145.34 46.18 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.865 -0.42 . . . . 71.519999999999996 109.865 176.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 503' ' ' PHE . . . . . 0.478 ' HA ' ' O ' ' A' ' 511' ' ' HIS . 44.6 p90 -114.86 140.9 48.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.592 0.711 . . . . 64.129999999999995 111.818 -175.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 504' ' ' LYS . . . . . 0.463 ' HB3' ' HB2' ' A' ' 511' ' ' HIS . 24.1 tptm -116.31 114.18 23.99 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.802 -1.09 . . . . 74.310000000000002 109.137 176.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.482 ' HD3' ' O ' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -112.37 138.37 49.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.06 0.457 . . . . 72.510000000000005 112.192 -176.169 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -149.59 85.41 1.44 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.836 -0.62 . . . . 62.149999999999999 109.855 170.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 69.5 -116.68 7.18 Favored Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 115.614 -0.721 . . . . 61.25 112.777 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 508' ' ' GLN . . . . . 0.665 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 4.1 pt20 -76.98 -25.95 53.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.708 0.29 . . . . 74.129999999999995 111.508 -177.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 509' ' ' ARG . 3.9 ptt180 -99.12 127.0 44.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.374 0.606 . . . . 71.140000000000001 111.448 -174.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -129.39 155.96 44.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.477 -0.783 . . . . 70.439999999999998 109.705 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 511' ' ' HIS . . . . . 0.478 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 80.4 m-70 -138.9 124.58 19.62 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.897 -0.408 . . . . 73.230000000000004 109.897 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 56.9 tp -111.46 106.09 14.89 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.929 -0.397 . . . . 62.420000000000002 109.929 176.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 513' ' ' ILE . . . . . 0.407 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.5 mp -103.25 118.41 50.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.06 0.457 . . . . 71.310000000000002 111.018 -176.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 514' ' ' ILE . . . . . 0.558 HG12 ' HB3' ' A' ' 501' ' ' TYR . 62.2 mt -101.9 121.76 53.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.145 -0.687 . . . . 74.25 109.145 174.255 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -64.14 -51.41 64.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.267 -0.424 . . . . 54.350000000000001 111.396 -174.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -133.01 114.87 14.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.342 -0.39 . . . . 73.200000000000003 110.151 175.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -62.69 127.53 31.7 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.695 -0.483 . . . . 75.120000000000005 109.695 173.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 28.6 ttm -132.58 173.68 11.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.976 -0.379 . . . . 74.310000000000002 109.976 -174.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.428 HD22 ' H ' ' A' ' 519' ' ' LEU . 3.4 mm? -53.43 -36.63 61.76 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.606 0.595 . . . . 74.010000000000005 112.606 -172.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 520' ' ' GLU . . . . . 0.486 ' H ' ' CD ' ' A' ' 520' ' ' GLU . 1.8 mp0 -58.92 -35.02 72.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.948 0.404 . . . . 74.140000000000001 110.895 -178.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -74.43 -13.52 60.72 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.995 -0.548 . . . . 73.430000000000007 112.223 -169.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 522' ' ' ALA . . . . . 0.588 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -63.78 7.33 0.12 Allowed 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.911 1.078 . . . . 72.329999999999998 113.911 -175.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -86.63 169.3 40.82 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.987 -0.625 . . . . 72.140000000000001 112.443 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -73.97 119.84 18.74 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 122.717 -0.284 . . . . 74.510000000000005 110.804 -178.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -86.43 135.0 33.66 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.765 0.317 . . . . 72.200000000000003 110.804 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.4 134.63 47.28 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.062 0.458 . . . . 44.530000000000001 110.475 175.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 527' ' ' LEU . . . . . 0.519 HD21 ' HB ' ' A' ' 484' ' ' VAL . 7.5 tt -118.04 111.85 19.46 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.053 -0.721 . . . . 71.430000000000007 109.053 177.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 43.9 t -99.24 128.1 45.32 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.926 0.393 . . . . 62.409999999999997 110.593 -177.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 529' ' ' THR . . . . . 0.529 HG22 ' H ' ' A' ' 530' ' ' SER . 1.8 m -117.88 175.47 5.65 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.892 -0.594 . . . . 75.329999999999998 109.45 176.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 530' ' ' SER . . . . . 0.529 ' H ' HG22 ' A' ' 529' ' ' THR . 9.1 m -58.52 -24.36 60.38 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.014 0.375 . . . . 42.119999999999997 112.014 178.163 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -112.28 -88.38 1.76 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.637 -0.792 . . . . 73.349999999999994 112.21 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -94.18 -172.25 38.58 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.819 -0.705 . . . . 43.219999999999999 112.016 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -145.49 147.55 32.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.005 0.431 . . . . 74.019999999999996 110.725 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 534' ' ' ALA . . . . . 0.433 ' HB2' HG21 ' A' ' 456' ' ' ILE . . . -105.75 118.71 37.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.007 -0.542 . . . . 75.329999999999998 110.115 178.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 7.5 tt -114.99 124.72 52.4 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.441 -0.577 . . . . 74.230000000000004 109.441 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -148.36 149.11 31.2 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.985 -0.552 . . . . 61.43 109.809 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -116.77 112.92 21.83 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.372 0.606 . . . . 72.230000000000004 111.052 -177.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.588 ' O ' ' HA ' ' A' ' 522' ' ' ALA . 31.3 tp -96.92 111.5 23.68 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.298 -0.864 . . . . 73.150000000000006 109.462 -179.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 539' ' ' ILE . . . . . 0.659 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 63.3 mt -97.47 129.11 48.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 110.129 -0.323 . . . . 63.340000000000003 110.129 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 34.7 t -111.54 116.47 52.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 61.420000000000002 110.601 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 541' ' ' GLN . . . . . 0.565 ' HG3' HD21 ' A' ' 464' ' ' LEU . 98.4 mt-30 -99.61 155.44 17.6 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.085 0.469 . . . . 75.340000000000003 111.173 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -80.56 149.75 29.82 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.615 -0.721 . . . . 74.219999999999999 110.654 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.723 -0.656 . . . . 73.420000000000002 110.157 -179.756 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo . . . . . 0 N--CA 1.458 -0.577 0 N-CA-C 111.537 -0.216 . . . . 43.44 111.537 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 48.2 t -66.34 115.83 4.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.623 -0.51 . . . . 72.43 109.623 176.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -78.59 143.57 36.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.172 -0.467 . . . . 34.12 110.884 -174.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.492 HG21 ' HB2' ' A' ' 534' ' ' ALA . 37.8 mm -95.49 110.77 24.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.356 -0.609 . . . . 63.3 109.356 175.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . 0.437 ' HB ' ' HG3' ' A' ' 476' ' ' GLU . 16.5 m -67.99 -40.91 82.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.019 0.438 . . . . 74.13 111.318 -175.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.716 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 19.5 mmt85 -116.67 120.39 34.43 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.152 -0.476 . . . . 62.12 110.472 -176.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -76.12 165.53 29.48 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 121.935 1.757 . . . . 62.32 110.45 170.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 3.7 mm? -80.43 149.03 30.29 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.647 -0.421 . . . . 65.14 109.98 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 23.5 mp0 -52.62 119.38 4.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.267 -0.879 . . . . 63.44 111.999 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -92.01 -11.24 36.53 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.819 -1.082 . . . . 72.24 112.154 -176.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -88.69 155.12 19.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.166 0.508 . . . . 62.4 111.139 -172.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 9.4 tt -87.81 136.14 33.08 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.624 -0.716 . . . . 73.44 109.751 -174.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 35.7 m -121.44 175.65 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.987 -0.552 . . . . 75.34 110.937 -176.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . 0.448 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 25.2 ptt? -120.85 152.25 38.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.199 -0.455 . . . . 72.33 111.077 -176.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 69.3 t -61.55 139.33 20.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.463 -0.79 . . . . 73.23 111.244 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.35 -18.34 54.01 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.76 -0.733 . . . . 61.23 114.105 173.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.448 ' HG2' ' O ' ' A' ' 466' ' ' MET . 9.7 pt20 -94.33 155.47 16.98 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 117.836 0.818 . . . . 75.12 110.953 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . 0.522 ' HG3' ' HA ' ' A' ' 515' ' ' ASN . 42.6 ttm180 -88.02 116.0 25.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.787 -0.642 . . . . 73.23 109.832 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.403 HG22 HE21 ' A' ' 469' ' ' GLN . 10.4 t -112.78 127.6 69.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.987 0.422 . . . . 65.52 110.877 -175.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -104.59 123.63 47.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.774 -0.648 . . . . 73.12 110.048 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.589 ' HE2' HD12 ' A' ' 514' ' ' ILE . 67.5 m-85 -107.39 134.34 50.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.209 -0.45 . . . . 72.43 109.941 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -122.96 118.43 27.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.03 0.443 . . . . 73.02 111.37 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 23.0 t -143.08 113.56 7.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.743 -0.662 . . . . 74.32 109.539 176.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.688 ' HB2' ' HA ' ' A' ' 509' ' ' ARG . 13.0 pt-20 -133.51 166.42 22.61 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.291 -0.413 . . . . 75.15 110.841 -177.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.545 HG21 ' HB3' ' A' ' 482' ' ' ALA . 6.7 m -101.09 159.56 3.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.757 -0.656 . . . . 72.1 110.505 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 22.2 t -80.79 -2.28 46.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.151 -0.477 . . . . 73.34 111.227 -176.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -134.17 132.8 40.23 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.691 -0.485 . . . . 63.11 109.691 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -78.94 153.02 30.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.179 0.514 . . . . 73.44 112.007 -173.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 95.62 -16.85 60.42 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.52 -0.763 . . . . 52.12 112.359 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.545 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -82.77 132.84 35.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.199 0.523 . . . . 72.43 111.521 -177.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -105.15 165.13 11.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.507 -0.769 . . . . 65.31 110.189 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.56 HG21 HD11 ' A' ' 527' ' ' LEU . 27.3 m -137.0 173.22 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.39 -0.368 . . . . 71.24 110.997 -174.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . 0.402 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 40.6 ttmt -117.44 140.32 49.74 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.08 -0.509 . . . . 60.13 109.649 174.145 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -98.71 124.05 43.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.152 0.501 . . . . 75.41 110.445 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . 0.406 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 53.2 tp -115.68 119.21 35.33 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.032 -0.729 . . . . 75.32 109.032 177.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.42 ' HE2' ' HA3' ' A' ' 523' ' ' GLY . 14.0 tmtt? -121.17 113.05 19.44 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.348 -0.387 . . . . 54.11 110.778 -175.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . 0.467 ' HB2' ' HA3' ' A' ' 523' ' ' GLY . 35.1 t0 55.22 37.92 29.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.483 -0.78 . . . . 70.41 111.43 173.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 85.03 -4.13 86.02 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.731 -0.747 . . . . 61.24 112.743 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 44.3 t -103.63 131.86 51.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 120.782 0.325 . . . . 71.33 110.387 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -83.29 113.96 21.06 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.669 -0.493 . . . . 74.24 109.669 177.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 92.9 mt -69.32 159.88 32.31 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.184 -0.462 . . . . 71.42 111.263 -176.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . 0.669 HG23 ' HG2' ' A' ' 496' ' ' GLU . 7.5 t -89.54 155.14 19.47 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.771 -0.649 . . . . 75.12 110.175 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.5 ttt-85 -79.25 77.04 5.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.724 0.297 . . . . 63.53 110.547 -177.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . 0.669 ' HG2' HG23 ' A' ' 494' ' ' THR . 8.4 pt-20 -176.46 147.25 0.66 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.891 -0.595 . . . . 64.23 109.749 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 502' ' ' TRP . 1.0 OUTLIER -104.52 171.32 7.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.966 0.412 . . . . 72.02 110.398 177.386 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.459 HG23 ' H ' ' A' ' 500' ' ' LYS . 7.8 t -149.04 -178.16 6.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.457 -0.572 . . . . 71.21 109.457 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -77.88 -3.84 43.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.793 0.33 . . . . 73.42 111.346 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . 0.459 ' H ' HG23 ' A' ' 498' ' ' THR . 64.2 tttp -82.8 -48.62 10.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.352 0.596 . . . . 64.1 109.535 174.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.615 ' HD2' HD11 ' A' ' 512' ' ' LEU . 19.7 p90 -151.71 141.66 22.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.364 -0.835 . . . . 75.21 109.371 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 502' ' ' TRP . . . . . 0.529 ' HZ3' ' HB2' ' A' ' 504' ' ' LYS . 55.0 p-90 -140.84 150.51 43.37 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.863 0.363 . . . . 72.52 110.602 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . 0.596 ' HA ' ' O ' ' A' ' 511' ' ' HIS . 41.1 p90 -124.76 139.67 53.64 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.14 -0.482 . . . . 70.23 110.147 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.529 ' HB2' ' HZ3' ' A' ' 502' ' ' TRP . 61.2 tttm -116.44 145.24 43.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.02 0.438 . . . . 63.51 110.688 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -107.0 141.78 37.66 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.52 -0.764 . . . . 72.25 109.911 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . 0.519 ' HB3' ' CG ' ' A' ' 509' ' ' ARG . 38.6 t70 -149.94 87.14 1.46 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.863 -0.421 . . . . 63.33 109.863 170.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.45 -87.96 0.2 Allowed Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.769 -0.65 . . . . 73.04 112.675 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -107.52 -27.23 10.52 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.09 0.471 . . . . 74.21 110.924 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.688 ' HA ' ' HB2' ' A' ' 476' ' ' GLU . 6.7 ptp180 -87.99 143.2 27.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.356 0.598 . . . . 72.51 111.684 -170.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -135.12 126.9 29.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.354 -0.839 . . . . 73.43 109.108 179.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . 0.596 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 25.8 m-70 -121.2 126.79 50.53 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.949 -0.389 . . . . 74.43 109.949 -177.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.615 HD11 ' HD2' ' A' ' 501' ' ' TYR . 62.8 tp -110.66 108.06 17.84 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.806 -0.442 . . . . 63.43 109.806 178.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.413 HD12 ' N ' ' A' ' 513' ' ' ILE . 3.7 mp -105.14 123.83 59.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 120.852 0.358 . . . . 74.41 110.648 -176.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.589 HD12 ' HE2' ' A' ' 473' ' ' PHE . 45.1 mt -105.53 122.15 58.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 64.31 109.522 175.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . 0.522 ' HA ' ' HG3' ' A' ' 470' ' ' ARG . 43.1 m-80 -66.13 -42.01 89.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.922 -0.581 . . . . 74.11 111.976 -172.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -140.94 116.02 9.86 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.352 -0.24 . . . . 74.54 110.352 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.417 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -62.6 123.46 18.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.924 -0.398 . . . . 63.12 109.924 175.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 45.0 tpp -132.65 171.94 13.19 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.697 -0.483 . . . . 75.42 109.697 -177.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -56.46 -32.28 64.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.571 0.224 . . . . 73.54 111.004 177.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -59.25 -37.25 77.11 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.402 0.62 . . . . 72.25 110.525 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -86.73 -13.22 45.96 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.119 -0.946 . . . . 44.14 110.894 -173.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.464 ' HB2' ' HB ' ' A' ' 540' ' ' VAL . . . -66.91 7.62 0.36 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.222 0.823 . . . . 53.24 113.222 -176.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . 0.467 ' HA3' ' HB2' ' A' ' 489' ' ' ASP . . . -79.23 165.96 50.99 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.701 -0.761 . . . . 73.04 112.309 178.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 57.1 m170 -71.07 151.39 44.57 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 122.76 -0.259 . . . . 71.04 110.625 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -124.83 124.86 42.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.19 0.519 . . . . 75.21 111.496 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.406 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -128.77 135.44 49.18 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.919 -0.582 . . . . 42.5 110.348 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.613 HD13 ' SG ' ' A' ' 475' ' ' CYS . 2.1 tt -107.95 107.83 18.71 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.999 -0.546 . . . . 73.12 109.909 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 70.2 m -88.8 114.85 25.86 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.073 -0.512 . . . . 74.51 111.676 -174.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.545 ' HB ' ' O ' ' A' ' 532' ' ' GLY . 9.3 m -119.19 158.16 26.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.681 -0.691 . . . . 73.25 109.669 173.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 12.5 m -68.26 -26.65 65.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.804 0.335 . . . . 74.22 111.387 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -87.89 -90.76 1.07 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.824 -0.703 . . . . 70.32 111.637 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . 0.545 ' O ' ' HB ' ' A' ' 529' ' ' THR . . . -97.34 176.05 31.15 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.639 -0.791 . . . . 63.14 111.272 174.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -141.07 126.95 19.23 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.874 -0.417 . . . . 64.2 109.874 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . 0.492 ' HB2' HG21 ' A' ' 456' ' ' ILE . . . -96.93 117.75 31.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.387 -0.369 . . . . 73.42 110.112 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.418 HD23 ' N ' ' A' ' 536' ' ' ALA . 5.4 tt -120.79 127.82 52.31 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.331 -0.618 . . . . 63.04 109.331 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.555 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -148.55 153.88 39.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.267 -0.424 . . . . 73.55 110.157 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -119.18 118.86 32.46 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.373 0.606 . . . . 70.13 110.775 -176.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 44.3 tp -96.86 136.71 37.03 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.942 -1.026 . . . . 75.34 110.125 -177.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.422 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 65.6 mt -116.77 113.36 42.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.148 -0.478 . . . . 73.1 109.783 175.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.464 ' HB ' ' HB2' ' A' ' 522' ' ' ALA . 44.1 t -101.74 105.48 18.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.886 -0.597 . . . . 73.32 109.695 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -88.49 151.15 22.73 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.241 0.543 . . . . 72.13 111.267 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -76.82 162.76 27.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.261 -0.881 . . . . 73.04 112.214 -169.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . 0.401 ' HB3' ' NZ ' ' A' ' 543' ' ' LYS . 8.2 mtpm? . . . . . 0 C--O 1.251 1.159 0 CA-C-N 115.087 -0.96 . . . . 63.21 109.174 173.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo . . . . . 0 N--CA 1.462 -0.37 0 N-CA-C 111.447 -0.251 . . . . 73.14 111.447 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.45 HG21 ' HB3' ' A' ' 530' ' ' SER . 48.3 t -67.12 110.21 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.809 0.338 . . . . 65.24 110.597 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 86.6 mt -78.83 130.47 35.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.968 -0.56 . . . . 73.55 110.524 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 45.7 mm -91.28 110.44 22.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.866 -0.606 . . . . 64.33 110.057 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 26.3 m -79.95 -28.87 39.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.29 -0.414 . . . . 75.05 111.346 -176.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.535 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 36.3 mmt-85 -126.35 119.02 23.26 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.61 -0.268 . . . . 63.3 111.077 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 458' ' ' ARG . 3.0 Cg_exo -76.06 167.27 26.36 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 123.062 2.508 . . . . 55.11 111.548 174.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 91.2 mt -81.94 169.58 16.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.646 0.26 . . . . 75.41 110.609 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -69.57 120.05 14.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.029 -0.532 . . . . 63.1 111.426 -175.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -93.61 -14.36 26.58 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.861 -0.608 . . . . 65.13 111.32 178.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.9 pm0 -90.73 157.42 17.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.335 0.588 . . . . 75.35 111.623 -173.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.483 HD11 HE21 ' A' ' 541' ' ' GLN . 10.5 tt -87.48 142.15 28.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.185 -0.916 . . . . 72.14 110.713 -170.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.487 HG23 HG22 ' A' ' 540' ' ' VAL . 28.9 m -126.75 174.0 11.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.996 -0.547 . . . . 64.11 110.269 -179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . 0.509 ' HG2' ' HG3' ' A' ' 541' ' ' GLN . 46.7 mtm -133.13 162.24 32.26 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.418 -0.355 . . . . 74.45 110.882 -178.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . 0.541 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 49.8 t -64.63 137.36 25.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.911 -0.586 . . . . 61.14 111.618 -176.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 100.93 -0.68 55.09 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.764 -0.731 . . . . 71.4 114.039 173.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -120.08 159.0 25.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.42 0.61 . . . . 63.24 110.715 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 514' ' ' ILE . 37.6 ttm105 -87.38 138.59 31.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 63.14 111.176 -175.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 47.1 t -115.96 133.34 62.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.92 -0.582 . . . . 62.32 110.454 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -109.21 122.81 48.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.203 -0.453 . . . . 71.14 110.036 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.653 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 64.9 m-85 -108.31 112.29 24.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.385 -0.371 . . . . 64.03 110.418 176.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.513 ' HG2' ' CE1' ' A' ' 511' ' ' HIS . 33.7 mt-10 -98.71 120.11 38.59 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.284 -0.636 . . . . 64.2 109.284 174.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.535 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 13.9 t -144.84 109.16 4.84 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.089 -0.708 . . . . 73.34 109.089 171.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.514 ' OE1' ' HB2' ' A' ' 509' ' ' ARG . 0.4 OUTLIER -113.93 134.63 54.7 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.699 -0.852 . . . . 74.11 108.699 -176.277 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.532 HG21 ' HB3' ' A' ' 482' ' ' ALA . 30.0 m -95.61 145.23 8.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.567 -0.531 . . . . 60.44 109.567 176.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 32.3 t -72.64 -11.73 60.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.328 -0.396 . . . . 61.31 111.721 -175.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -133.12 137.62 46.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.846 0.355 . . . . 65.04 111.886 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -71.01 149.3 46.77 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.855 -0.611 . . . . 75.31 109.663 174.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 84.42 15.43 68.83 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.663 -0.78 . . . . 72.55 112.34 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.532 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -91.73 110.47 21.81 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.799 0.333 . . . . 72.05 110.733 177.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.53 143.89 55.91 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.948 -0.569 . . . . 63.14 110.515 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 22.3 m -128.62 143.41 41.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.215 -0.448 . . . . 73.54 110.497 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . 0.48 ' HB3' ' HB3' ' A' ' 528' ' ' CYS . 25.1 ttmm -129.09 129.25 44.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.056 -0.52 . . . . 65.12 110.155 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -98.46 119.77 37.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.124 0.488 . . . . 75.51 110.762 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 7.8 tt -116.99 119.74 36.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.734 -0.666 . . . . 74.23 109.331 178.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -105.05 105.73 15.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.418 -0.356 . . . . 74.31 110.815 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . 0.454 ' HB2' ' HA3' ' A' ' 523' ' ' GLY . 4.0 t70 46.88 46.33 15.44 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.257 -0.883 . . . . 65.33 111.33 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.36 -27.25 20.29 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.743 -0.662 . . . . 72.11 113.22 177.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 47.5 t -101.5 119.22 49.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 117.12 0.46 . . . . 63.44 110.775 -176.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -65.32 128.73 37.06 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.725 -0.472 . . . . 71.04 109.725 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 4.4 pp -91.52 163.13 14.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.758 0.313 . . . . 71.44 110.301 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 2.4 p -100.05 142.66 31.23 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.086 0.47 . . . . 72.11 111.583 -176.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.41 2.29 9.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.652 -0.703 . . . . 73.23 111.427 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -126.77 34.68 4.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.156 -0.475 . . . . 62.03 110.767 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -82.98 -179.94 7.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.892 -0.594 . . . . 61.31 111.396 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 13.7 t -65.11 165.71 10.77 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.824 -0.626 . . . . 72.24 111.635 -176.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -74.93 14.26 0.54 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.626 -0.715 . . . . 63.44 112.603 -173.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -59.15 -44.93 92.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.214 0.53 . . . . 72.42 110.218 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.428 ' CB ' HG12 ' A' ' 514' ' ' ILE . 1.5 p90 -144.62 125.04 13.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.516 -0.766 . . . . 74.1 109.681 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -123.26 160.24 27.04 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.831 -0.622 . . . . 70.34 110.162 -174.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -124.02 151.08 44.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.14 0.495 . . . . 65.1 111.357 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -117.16 138.27 51.78 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.524 -0.762 . . . . 52.25 109.939 175.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.57 ' NZ ' ' HB3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -113.77 105.1 12.88 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.66 -0.867 . . . . 75.04 108.66 175.806 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . 0.638 ' HB2' ' HG2' ' A' ' 509' ' ' ARG . 32.4 m-20 -115.39 88.36 2.86 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.565 -0.531 . . . . 72.21 109.565 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 64.15 -94.8 0.16 Allowed Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.873 -0.603 . . . . 52.33 112.584 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.501 ' O ' HG22 ' A' ' 477' ' ' VAL . 20.2 pt20 -103.31 -20.69 14.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.898 0.38 . . . . 75.15 111.108 -177.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.638 ' HG2' ' HB2' ' A' ' 506' ' ' ASP . 28.6 ptt180 -92.28 148.87 21.8 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.441 -0.504 . . . . 74.53 111.075 -172.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -134.47 117.13 15.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.783 -0.644 . . . . 71.13 109.906 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . 0.513 ' CE1' ' HG2' ' A' ' 474' ' ' GLU . 23.1 m-70 -121.22 126.79 50.49 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.806 -0.358 . . . . 71.14 111.098 -177.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.4 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 58.3 tp -107.33 117.36 33.86 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.107 -0.701 . . . . 72.51 109.107 176.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 68.6 mt -111.51 108.33 25.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 120.961 0.41 . . . . 71.45 110.871 -175.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.504 ' O ' ' HG3' ' A' ' 470' ' ' ARG . 35.8 mt -86.86 120.55 36.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.543 -0.91 . . . . 75.23 108.543 173.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -68.61 -45.88 70.77 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.899 -0.32 . . . . 54.41 110.715 -176.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -140.61 109.12 5.89 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.641 -0.503 . . . . 72.24 109.641 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.541 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -64.62 136.43 56.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.954 -0.566 . . . . 72.12 111.013 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 72.1 mtm -134.16 174.91 9.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.96 -0.563 . . . . 75.43 110.521 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.463 ' H ' HD22 ' A' ' 519' ' ' LEU . 3.1 mm? -53.53 -33.0 52.96 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.769 0.655 . . . . 64.23 112.769 -171.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.71 -29.7 68.3 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.412 0.625 . . . . 74.25 111.297 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . 0.482 ' HB2' HG21 ' A' ' 540' ' ' VAL . 30.3 m-20 -82.14 -11.86 58.5 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.326 -0.852 . . . . 74.3 111.462 -170.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.497 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -67.22 6.61 0.53 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.394 0.516 . . . . 74.21 112.394 178.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . 0.454 ' HA3' ' HB2' ' A' ' 489' ' ' ASP . . . -80.99 167.99 50.37 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 121.051 -0.595 . . . . 54.34 112.359 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . 0.423 ' CD2' ' HB3' ' A' ' 537' ' ' GLU . 62.8 m80 -79.86 106.58 11.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.688 0.28 . . . . 73.43 110.935 -178.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -76.57 124.36 27.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.383 0.611 . . . . 74.44 111.035 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -123.75 135.95 54.14 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.464 -0.789 . . . . 50.15 109.585 175.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.623 ' HB3' ' HB3' ' A' ' 534' ' ' ALA . 6.2 tt -117.2 108.64 15.91 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.425 -0.583 . . . . 71.23 109.425 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . 0.48 ' HB3' ' HB3' ' A' ' 485' ' ' LYS . 42.3 t -86.76 115.29 24.1 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.051 -0.722 . . . . 65.13 109.051 176.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.436 HG22 ' H ' ' A' ' 530' ' ' SER . 0.2 OUTLIER -95.3 175.18 6.69 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.501 -0.318 . . . . 64.15 110.417 -176.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . 0.45 ' HB3' HG21 ' A' ' 454' ' ' VAL . 22.9 t -65.3 -5.99 8.69 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.922 0.391 . . . . 71.1 111.313 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -149.5 -54.81 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.711 -0.757 . . . . 60.31 112.469 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -95.47 -171.49 36.31 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.803 -0.713 . . . . 41.43 112.837 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -140.98 136.93 32.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.876 0.37 . . . . 70.24 110.407 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . 0.623 ' HB3' ' HB3' ' A' ' 527' ' ' LEU . . . -115.98 143.52 45.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.119 -0.491 . . . . 61.51 109.954 176.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 64.3 tp -147.29 126.19 12.75 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.62 -0.264 . . . . 75.21 110.445 -178.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -150.1 152.01 34.09 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.259 -0.428 . . . . 53.54 110.208 177.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . 0.423 ' HB3' ' CD2' ' A' ' 524' ' ' HIS . 10.4 pt-20 -108.38 113.98 27.48 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.148 0.499 . . . . 73.11 110.41 178.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.653 HD22 ' HZ ' ' A' ' 473' ' ' PHE . 39.4 tp -96.3 111.43 23.5 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.928 -0.767 . . . . 62.33 108.928 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 48.4 mt -93.06 112.74 26.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 116.409 -0.36 . . . . 63.24 110.342 -177.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.487 HG22 HG23 ' A' ' 465' ' ' VAL . 24.6 t -109.4 113.14 43.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.831 -0.622 . . . . 71.14 109.787 177.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . 0.509 ' HG3' ' HG2' ' A' ' 466' ' ' MET . 8.0 pt20 -115.18 157.24 23.93 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.023 0.439 . . . . 72.02 110.978 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -78.69 135.23 37.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.541 -0.754 . . . . 74.23 110.282 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . 0.444 ' HE2' ' O ' ' A' ' 467' ' ' VAL . 59.0 pttt . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.735 -0.65 . . . . 72.13 109.901 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo . . . . . 0 N--CA 1.458 -0.603 0 N-CA-C 111.405 -0.267 . . . . 74.25 111.405 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 56.9 t -66.92 112.48 2.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 109.926 -0.398 . . . . 60.21 109.926 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 89.6 mt -90.06 144.09 26.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.521 . . . . 65.4 111.458 -175.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.493 HD13 HG12 ' A' ' 477' ' ' VAL . 42.9 mm -104.73 113.6 42.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.649 -0.705 . . . . 75.55 109.876 178.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . 0.413 ' OG1' ' HG3' ' A' ' 476' ' ' GLU . 2.9 p -93.8 -4.84 49.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.843 0.354 . . . . 63.44 111.873 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.618 ' HB2' ' HG2' ' A' ' 476' ' ' GLU . 0.0 OUTLIER -135.02 99.68 12.25 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.562 -0.29 . . . . 74.44 110.544 177.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -71.64 167.15 27.27 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.651 2.234 . . . . 72.3 111.973 174.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.588 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 79.0 mt -83.66 171.05 13.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.275 -0.42 . . . . 72.03 111.407 -175.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . 0.441 ' HB2' ' HE1' ' A' ' 473' ' ' PHE . 7.8 mm-40 -67.7 118.38 10.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.921 -0.581 . . . . 63.21 111.089 -179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -95.37 -11.24 28.06 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.908 -0.587 . . . . 74.32 111.838 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -88.65 157.5 18.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.293 0.568 . . . . 73.43 111.794 -170.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 8.8 tt -87.24 131.88 34.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.394 -0.821 . . . . 74.21 110.228 -172.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 33.1 m -124.92 176.24 6.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.871 -0.604 . . . . 71.21 110.659 -177.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -113.69 157.51 22.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.046 0.451 . . . . 60.43 110.926 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 73.3 t -66.49 138.67 22.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.549 -0.751 . . . . 74.34 111.272 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.01 -2.06 55.25 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.913 -0.661 . . . . 71.25 114.004 174.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -110.28 163.08 13.99 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 117.671 0.736 . . . . 75.25 111.068 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -82.28 131.03 35.23 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.725 -0.671 . . . . 72.34 110.863 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 60.7 t -131.61 122.0 49.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.243 -0.435 . . . . 74.2 110.169 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.62 ' HG2' HG12 ' A' ' 513' ' ' ILE . 21.8 mt-10 -101.68 138.58 38.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.079 0.466 . . . . 64.34 111.222 176.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.647 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 35.3 m-85 -105.69 112.98 26.27 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.943 -0.762 . . . . 71.23 108.943 171.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.421 ' HB2' ' HE ' ' A' ' 458' ' ' ARG . 42.8 mt-10 -98.29 117.63 33.12 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.467 -0.568 . . . . 63.01 109.467 179.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.504 ' HA ' ' HB3' ' A' ' 458' ' ' ARG . 22.5 t -132.72 125.28 29.87 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.793 -0.447 . . . . 74.44 109.793 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.618 ' HG2' ' HB2' ' A' ' 458' ' ' ARG . 11.3 pt-20 -133.08 153.76 51.21 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.958 -0.564 . . . . 73.22 109.996 178.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.559 HG21 ' HB3' ' A' ' 482' ' ' ALA . 8.1 m -117.37 155.49 19.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 115.465 -0.789 . . . . 64.43 109.906 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 6.5 p -81.16 -2.44 48.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.056 0.455 . . . . 75.23 111.638 -177.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -124.4 130.47 52.54 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.604 -0.887 . . . . 71.44 108.604 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -89.13 132.76 34.67 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.226 0.536 . . . . 45.32 111.605 -174.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 102.73 6.42 46.58 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.81 -0.71 . . . . 24.12 111.975 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.559 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -82.13 127.53 33.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.694 0.283 . . . . 55.3 110.481 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -80.09 142.85 34.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.117 -0.492 . . . . 73.33 110.671 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.54 HG12 HG22 ' A' ' 529' ' ' THR . 35.7 m -124.04 148.77 28.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.965 -0.561 . . . . 71.31 110.579 -177.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . 0.41 ' HA ' ' HE3' ' A' ' 485' ' ' LYS . 1.3 tpmt? -127.29 134.84 49.98 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.25 -0.432 . . . . 74.23 110.238 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -97.85 120.83 38.94 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.941 -0.392 . . . . 74.42 109.941 177.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 51.0 tp -116.82 120.61 39.05 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.651 -0.5 . . . . 55.25 109.651 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.442 ' HD3' ' C ' ' A' ' 488' ' ' LYS . 14.2 tmtt? -109.3 106.89 16.9 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.862 0.363 . . . . 74.34 110.599 -176.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.6 t70 51.02 37.86 18.95 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.534 -0.757 . . . . 65.13 111.871 174.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 91.92 -14.04 65.33 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.769 -0.729 . . . . 52.53 112.641 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 40.0 t -94.33 130.0 43.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.783 0.325 . . . . 73.12 110.171 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -89.96 114.66 26.52 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.546 -0.909 . . . . 74.52 108.546 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.519 ' O ' HD12 ' A' ' 493' ' ' LEU . 2.2 pp -74.0 134.35 43.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.703 0.763 . . . . 75.43 112.125 -172.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.93 174.53 11.52 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.079 -0.964 . . . . 64.53 111.265 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . 0.462 ' N ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -115.81 22.58 12.95 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.865 0.32 . . . . 73.34 111.865 -167.81 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 19.9 pm0 -126.74 20.25 7.15 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.661 0.245 . . . . 74.33 111.661 -177.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -82.87 159.94 22.26 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.579 0.228 . . . . 75.34 110.627 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.442 HG23 ' H ' ' A' ' 500' ' ' LYS . 14.2 t -75.83 -179.67 4.95 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.149 0.499 . . . . 71.15 111.463 -176.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -81.28 19.64 0.93 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.672 0.619 . . . . 55.53 112.672 -172.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . 0.523 ' O ' ' HB3' ' A' ' 515' ' ' ASN . 58.7 tttp -63.17 -21.52 66.26 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.832 -0.803 . . . . 72.11 108.832 173.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.503 ' HB2' ' HA ' ' A' ' 514' ' ' ILE . 21.1 p90 -155.16 147.42 23.83 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 108.015 -1.105 . . . . 71.51 108.015 167.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 8.5 p-90 -154.09 159.12 41.36 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.212 -0.292 . . . . 74.24 110.212 -175.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -111.31 161.24 16.25 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.699 -0.4 . . . . 74.12 111.309 -177.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.978 ' HG2' ' HB2' ' A' ' 511' ' ' HIS . 14.4 ptpt -129.73 149.54 51.43 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 109.028 -0.73 . . . . 70.44 109.028 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.45 121.37 44.09 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.853 0.359 . . . . 73.22 110.509 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -115.97 80.96 1.52 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.568 -0.53 . . . . 62.31 109.568 175.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.65 -110.33 3.39 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.796 -0.716 . . . . 52.14 112.293 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -95.28 -5.54 43.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.347 0.594 . . . . 74.33 110.191 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.57 ' HG2' ' CB ' ' A' ' 476' ' ' GLU . 68.4 mtt85 -100.17 134.15 43.53 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.592 -0.731 . . . . 74.32 110.546 -175.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -116.51 134.38 54.92 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.825 0.345 . . . . 73.53 110.511 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . 0.978 ' HB2' ' HG2' ' A' ' 504' ' ' LYS . 11.5 m170 -117.91 123.2 45.25 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.111 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.467 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 46.7 tp -98.26 105.6 17.77 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.452 -0.573 . . . . 61.12 109.452 172.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.726 HD11 ' HE2' ' A' ' 504' ' ' LYS . 16.4 mt -93.67 107.6 19.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.937 -0.574 . . . . 73.52 110.451 -176.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.503 ' HA ' ' HB2' ' A' ' 501' ' ' TYR . 45.4 mt -78.13 114.89 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 106.615 -1.624 . . . . 73.25 106.615 168.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . 0.523 ' HB3' ' O ' ' A' ' 500' ' ' LYS . 9.3 t30 -72.51 -42.04 65.24 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.356 0.598 . . . . 65.12 109.838 -176.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -130.95 104.1 6.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.294 -0.866 . . . . 65.31 109.919 174.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -55.64 133.87 50.83 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.218 -0.66 . . . . 63.22 109.218 173.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . 0.524 ' H ' ' HB3' ' A' ' 521' ' ' ASP . 6.9 tpt -134.18 171.53 14.11 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.814 0.34 . . . . 63.0 111.389 -169.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.778 HD11 ' HB2' ' A' ' 542' ' ' GLU . 3.8 mm? -64.75 -49.27 71.43 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.306 -0.406 . . . . 75.04 111.699 -178.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -67.77 -22.41 65.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.141 0.496 . . . . 63.11 109.88 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . 0.524 ' HB3' ' H ' ' A' ' 518' ' ' MET . 16.6 t70 -74.74 -16.5 60.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.246 -0.888 . . . . 73.42 111.115 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.448 ' HB2' ' HB ' ' A' ' 540' ' ' VAL . . . -67.96 7.94 0.47 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.788 0.662 . . . . 44.55 112.788 -178.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -73.77 169.42 53.57 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 121.079 -0.581 . . . . 55.21 112.111 178.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 65.1 m170 -72.49 147.07 46.39 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.487 -0.42 . . . . 72.53 110.16 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -119.78 135.53 54.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.143 0.497 . . . . 74.22 111.431 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.45 ' HB2' ' HG ' ' A' ' 535' ' ' LEU . . . -144.06 135.46 25.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.839 -0.619 . . . . 34.34 110.637 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 10.5 tt -113.25 129.37 56.54 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.111 -0.7 . . . . 73.2 109.111 175.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 28.1 t -117.71 137.15 52.88 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.835 0.35 . . . . 74.1 110.27 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.54 HG22 HG12 ' A' ' 484' ' ' VAL . 67.5 p -109.55 -174.2 2.44 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.026 -0.534 . . . . 74.32 109.885 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 3.6 m -66.6 -11.17 52.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.167 -0.47 . . . . 65.41 110.651 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -115.8 -90.47 1.64 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 121.149 -0.548 . . . . 52.13 112.293 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -104.32 -173.06 25.08 Favored Glycine 0 C--O 1.236 0.221 0 C-N-CA 120.675 -0.774 . . . . 52.3 112.613 -178.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -133.83 156.74 47.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.895 0.379 . . . . 74.02 110.802 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -125.62 117.79 24.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.847 -0.615 . . . . 72.13 109.867 175.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.45 ' HG ' ' HB2' ' A' ' 526' ' ' ALA . 7.2 tt -118.37 132.85 56.25 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.347 -0.388 . . . . 75.22 110.414 -176.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.588 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -148.79 142.06 25.11 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.831 -0.622 . . . . 75.51 109.652 176.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -97.74 119.44 36.33 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.405 0.621 . . . . 71.0 111.042 -177.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.647 HD22 ' HZ ' ' A' ' 473' ' ' PHE . 43.8 tp -96.49 112.51 24.23 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.668 -0.697 . . . . 75.43 109.319 177.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 52.9 mt -93.64 112.16 26.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.694 -0.484 . . . . 63.11 109.694 178.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.448 ' HB ' ' HB2' ' A' ' 522' ' ' ALA . 23.4 t -106.16 110.97 33.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.111 -0.495 . . . . 73.1 110.138 -179.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -94.11 138.4 32.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.09 -0.505 . . . . 74.51 110.789 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . 0.779 ' HG2' ' HD3' ' A' ' 543' ' ' LYS . 21.3 tt0 -79.18 159.46 27.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.3 -0.409 . . . . 71.23 109.919 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . 0.779 ' HD3' ' HG2' ' A' ' 542' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.473 -0.775 . . . . 51.51 110.498 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo . . . . . 0 N--CA 1.464 -0.261 0 CA-C-O 120.695 0.206 . . . . 71.21 111.737 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.435 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 30.6 t -65.94 123.75 19.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.419 -0.355 . . . . 54.41 110.275 -177.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 6.6 mp -78.55 140.22 38.54 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.953 -0.567 . . . . 50.13 110.859 -177.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.588 HG13 ' HB2' ' A' ' 534' ' ' ALA . 33.7 mm -91.86 112.04 25.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.577 -0.738 . . . . 62.12 109.432 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . 0.421 ' OG1' ' HG3' ' A' ' 476' ' ' GLU . 0.4 OUTLIER -85.29 -25.62 27.1 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.095 0.405 . . . . 64.43 112.095 -177.041 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.502 ' HB2' ' HG2' ' A' ' 476' ' ' GLU . 6.4 mmm180 -130.61 111.66 16.32 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 110.096 -0.335 . . . . 72.45 110.096 177.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.15 168.5 23.9 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.966 2.444 . . . . 75.13 112.019 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.499 HD21 ' HB2' ' A' ' 527' ' ' LEU . 3.5 mm? -80.22 160.08 25.72 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.924 -0.398 . . . . 51.03 109.924 -178.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . 0.591 ' HG2' ' HD1' ' A' ' 473' ' ' PHE . 27.1 mm-40 -58.55 119.02 6.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.904 -0.589 . . . . 73.03 111.071 -176.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -93.15 -10.94 34.08 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.675 -0.693 . . . . 72.14 111.616 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . 0.575 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 6.0 pm0 -88.53 156.51 19.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.117 0.484 . . . . 73.12 111.254 -174.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 10.5 tt -87.07 138.39 31.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.661 -0.7 . . . . 61.2 110.981 -168.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.559 HG22 HD11 ' A' ' 538' ' ' LEU . 29.7 m -125.98 177.6 5.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.74 -0.664 . . . . 72.12 110.809 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . 0.49 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 38.1 mtm -133.62 156.1 48.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.758 0.314 . . . . 74.31 111.202 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . 0.491 ' CG2' ' HA ' ' A' ' 542' ' ' GLU . 55.8 t -64.53 144.47 14.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.684 -0.689 . . . . 71.2 111.768 -178.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 102.26 -25.25 28.37 Favored Glycine 0 C--N 1.332 0.307 0 CA-C-N 115.948 -0.569 . . . . 70.45 113.627 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 466' ' ' MET . 13.2 pt20 -98.23 168.35 10.29 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 117.237 0.519 . . . . 62.3 110.365 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 24.9 ttm180 -84.93 136.66 33.53 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.913 -0.403 . . . . 73.03 109.913 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 23.4 t -122.09 122.12 65.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.619 -0.511 . . . . 70.52 109.619 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.55 ' HG2' HG23 ' A' ' 513' ' ' ILE . 49.5 mt-10 -116.54 128.47 55.46 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.74 0.305 . . . . 72.2 110.56 -178.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.714 ' HD2' HD23 ' A' ' 512' ' ' LEU . 20.0 m-85 -105.06 127.15 52.75 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.327 -0.62 . . . . 65.41 109.327 179.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -111.55 116.75 31.36 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.109 0.481 . . . . 70.22 110.048 176.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 25.9 p -138.74 158.21 44.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.678 -0.692 . . . . 62.23 110.042 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.511 ' HB3' ' HG2' ' A' ' 509' ' ' ARG . 7.8 pt-20 -161.24 170.55 20.04 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.368 -0.378 . . . . 72.21 110.16 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.657 HG21 ' HB3' ' A' ' 482' ' ' ALA . 19.9 m -126.16 168.48 19.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.641 -0.708 . . . . 73.22 109.827 177.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 7.8 t -81.26 -1.05 43.49 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.439 -0.346 . . . . 42.11 111.322 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -117.2 133.96 55.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.087 0.47 . . . . 73.41 110.691 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -71.75 124.78 25.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 74.42 111.668 -175.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 71.72 31.91 64.62 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.108 -0.568 . . . . 71.12 113.284 174.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.657 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -81.56 133.37 35.37 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 122.607 -0.349 . . . . 74.43 110.535 176.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -68.23 142.49 55.62 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.695 -0.684 . . . . 74.44 110.395 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.524 HG12 HG22 ' A' ' 529' ' ' THR . 27.4 m -124.9 146.34 30.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.198 0.523 . . . . 71.1 110.76 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -117.9 135.53 54.05 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.412 -0.813 . . . . 74.43 109.053 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . 0.577 ' HB3' HD12 ' A' ' 493' ' ' LEU . 99.2 m95 -98.05 121.42 39.95 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.219 0.533 . . . . 75.05 110.312 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 20.2 tp -116.11 151.68 35.13 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.409 -0.814 . . . . 73.01 109.292 -178.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -136.86 105.22 5.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.803 0.335 . . . . 73.34 110.454 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 16.0 t70 47.13 40.22 9.49 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.326 -0.852 . . . . 74.44 111.663 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.47 -26.3 24.38 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.808 -0.711 . . . . 71.44 113.212 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 57.9 t -91.64 135.82 26.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 110.032 -0.359 . . . . 51.5 110.032 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -83.53 136.08 34.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.522 0.201 . . . . 75.52 110.564 -177.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.577 HD12 ' HB3' ' A' ' 486' ' ' TRP . 70.1 mt -69.09 153.89 42.98 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.946 -0.39 . . . . 72.22 109.946 178.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . 0.522 HG22 ' HG2' ' A' ' 496' ' ' GLU . 1.3 m -74.98 142.19 43.92 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.19 0.519 . . . . 74.4 112.104 -170.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 10.6 ptp85 -68.44 -20.75 64.66 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.744 -0.662 . . . . 75.04 110.431 175.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . 0.522 ' HG2' HG22 ' A' ' 494' ' ' THR . 9.1 pt-20 -116.52 39.11 3.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.278 -0.874 . . . . 73.14 109.204 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 494' ' ' THR . 7.3 tp10 -62.85 154.88 28.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.192 -0.913 . . . . 70.54 111.568 -174.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 9.6 t -60.22 150.6 29.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.511 -0.768 . . . . 73.44 111.396 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -86.23 18.25 3.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.002 -0.544 . . . . 71.22 111.248 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . 0.418 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 39.6 tttp -72.61 -24.24 61.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.358 -0.608 . . . . 71.1 109.358 177.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.483 ' CB ' ' HA ' ' A' ' 514' ' ' ILE . 13.4 p90 -146.14 138.52 25.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.285 -0.871 . . . . 64.21 108.96 173.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -135.39 160.24 39.05 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.855 0.359 . . . . 70.14 111.446 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . 0.439 ' HB3' HD13 ' A' ' 512' ' ' LEU . 40.8 p90 -119.17 138.26 53.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.115 0.483 . . . . 75.34 110.734 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -116.89 131.4 56.96 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.707 -0.678 . . . . 60.23 110.274 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -101.53 128.47 47.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.419 -0.355 . . . . 71.25 110.653 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -135.56 81.75 1.91 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.075 -0.511 . . . . 64.05 109.742 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 75.14 -118.0 5.47 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 121.007 -0.616 . . . . 75.05 112.151 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -86.11 -13.88 45.9 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.94 0.4 . . . . 75.31 110.407 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.511 ' HG2' ' HB3' ' A' ' 476' ' ' GLU . 70.6 mtt180 -97.58 139.14 33.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.408 0.623 . . . . 74.14 111.497 -174.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -130.44 119.18 22.29 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.401 -0.818 . . . . 70.22 109.638 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 41.7 m-70 -105.54 124.91 50.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.438 -0.346 . . . . 63.43 110.189 -177.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.714 HD23 ' HD2' ' A' ' 473' ' ' PHE . 50.6 tp -106.31 105.86 16.1 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.696 -0.483 . . . . 71.03 109.696 176.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.55 HG23 ' HG2' ' A' ' 472' ' ' GLU . 4.8 mp -101.75 110.6 28.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 116.187 -0.461 . . . . 71.33 110.622 -174.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.483 ' HA ' ' CB ' ' A' ' 501' ' ' TYR . 55.4 mt -92.4 116.99 34.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 108.575 -0.898 . . . . 74.5 108.575 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -70.64 -42.76 70.43 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.1 -0.5 . . . . 61.24 111.345 -175.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . 0.418 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 26.2 mt-10 -134.17 105.24 6.56 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.871 -0.604 . . . . 63.42 109.627 -178.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.469 ' O ' HG13 ' A' ' 467' ' ' VAL . . . -56.53 123.04 13.43 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.548 0.53 . . . . 60.11 110.306 177.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 14.4 tpt -113.81 169.09 9.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.133 -0.485 . . . . 73.21 110.111 -175.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 1.004 ' HG ' ' HG2' ' A' ' 542' ' ' GLU . 7.2 mp -58.12 -33.04 68.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.108 0.48 . . . . 55.51 110.491 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -60.91 -32.48 71.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.473 -0.785 . . . . 74.14 112.233 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -69.32 -14.23 62.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.766 0.317 . . . . 75.3 111.818 -172.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -62.71 -23.23 67.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.086 0.469 . . . . 74.2 110.088 172.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -67.54 123.73 20.35 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.824 -0.91 . . . . 23.21 110.824 173.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -66.76 125.74 26.82 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.127 0.489 . . . . 45.12 111.694 -170.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -92.95 152.48 19.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.594 -0.73 . . . . 65.14 110.522 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.51 143.24 43.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.965 -0.561 . . . . 74.1 110.744 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.499 ' HB2' HD21 ' A' ' 460' ' ' LEU . 58.6 tp -100.97 114.13 27.75 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.049 -0.523 . . . . 61.32 109.907 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 42.3 t -112.89 128.82 56.57 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.191 -0.459 . . . . 63.4 110.08 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.524 HG22 HG12 ' A' ' 484' ' ' VAL . 75.8 p -114.69 -174.3 2.46 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.492 -0.559 . . . . 74.11 109.492 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 12.4 p -68.0 -8.93 41.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.65 -0.25 . . . . 60.2 111.575 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -143.68 -48.55 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.705 -0.759 . . . . 21.33 113.301 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -98.74 156.97 20.22 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.646 -0.788 . . . . 54.0 113.121 -174.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -131.99 125.43 31.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.368 0.267 . . . . 73.33 110.292 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . 0.588 ' HB2' HG13 ' A' ' 456' ' ' ILE . . . -121.53 118.1 28.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.708 -0.224 . . . . 53.43 110.791 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 64.0 tp -109.66 138.96 45.27 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.996 0.427 . . . . 74.41 110.622 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -139.52 145.17 38.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.758 -0.656 . . . . 24.4 109.557 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -105.63 110.0 22.16 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.544 0.688 . . . . 73.31 110.458 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.559 HD11 HG22 ' A' ' 465' ' ' VAL . 49.1 tp -103.39 132.58 49.53 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.534 -0.757 . . . . 72.2 110.037 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.555 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 67.8 mt -117.85 112.92 40.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.723 -0.473 . . . . 72.52 109.723 176.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.438 HG22 HG23 ' A' ' 465' ' ' VAL . 45.8 t -108.39 108.65 25.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.302 -0.408 . . . . 75.41 110.244 -179.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -85.55 134.08 34.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.921 0.391 . . . . 63.43 110.41 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . 1.004 ' HG2' ' HG ' ' A' ' 519' ' ' LEU . 1.0 OUTLIER -83.95 149.82 26.06 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.706 -0.679 . . . . 62.23 111.404 -174.325 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 C--O 1.249 1.046 0 CA-C-N 115.58 -0.736 . . . . 75.21 109.532 175.234 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo . . . . . 0 C--O 1.234 0.275 0 CA-C-O 121.003 0.335 . . . . 62.4 112.494 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.452 ' H ' ' HA3' ' A' ' 531' ' ' GLY . 57.3 t -66.87 116.11 5.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.982 -0.553 . . . . 73.51 109.583 175.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.31 153.14 17.82 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.045 0.45 . . . . 70.24 110.977 -174.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.416 HG22 ' H ' ' A' ' 458' ' ' ARG . 27.7 mm -105.76 117.83 52.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.785 -0.643 . . . . 74.14 109.733 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . 0.58 ' CG2' ' HB2' ' A' ' 476' ' ' GLU . 15.1 t -91.26 2.63 56.23 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.271 0.558 . . . . 65.33 110.763 -177.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.428 ' HB2' ' H ' ' A' ' 476' ' ' GLU . 75.4 mmt-85 -138.84 94.5 10.14 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.708 -0.678 . . . . 71.21 109.663 173.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -67.45 157.31 62.37 Favored 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.479 2.12 . . . . 70.32 111.467 178.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.434 HD12 ' HB3' ' A' ' 473' ' ' PHE . 3.1 mm? -80.96 146.66 30.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.357 -0.609 . . . . 53.3 109.357 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . 0.657 ' HB2' ' OE1' ' A' ' 463' ' ' GLN . 6.0 pt-20 -82.91 126.77 32.86 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.968 0.889 . . . . 73.12 112.462 -171.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -92.55 -6.94 48.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 113.934 -1.485 . . . . 64.25 112.791 -173.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . 0.657 ' OE1' ' HB2' ' A' ' 461' ' ' GLU . 4.6 pm0 -83.73 161.33 21.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.294 0.569 . . . . 75.2 110.954 -169.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.834 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 1.2 tt -84.72 132.1 34.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.339 -0.846 . . . . 63.2 111.609 -161.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 33.0 m -120.81 177.73 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.357 -0.838 . . . . 63.0 109.693 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . 0.453 ' O ' ' HB3' ' A' ' 469' ' ' GLN . 23.0 ptp -124.5 163.11 22.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.696 0.284 . . . . 75.01 111.017 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 541' ' ' GLN . 59.6 t -62.53 130.31 26.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 70.13 111.179 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . 0.445 ' HA2' ' HB3' ' A' ' 516' ' ' GLU . . . 93.48 -11.88 70.65 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.937 -0.649 . . . . 72.43 112.353 178.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.453 ' HB3' ' O ' ' A' ' 466' ' ' MET . 29.5 tt0 -76.31 132.37 39.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.951 0.405 . . . . 72.12 111.035 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -73.86 127.04 31.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.609 -0.723 . . . . 74.04 110.251 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 47.5 t -132.52 126.86 55.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.202 -0.454 . . . . 65.24 110.601 -178.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -103.86 131.07 51.42 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.126 -0.324 . . . . 72.34 110.126 174.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.434 ' HB3' HD12 ' A' ' 460' ' ' LEU . 55.0 m-85 -107.07 110.98 23.24 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.124 -0.489 . . . . 71.43 109.748 176.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -104.97 129.86 53.29 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.346 -0.388 . . . . 73.41 110.296 -178.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 9.0 p -143.46 111.68 6.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.219 0.533 . . . . 64.13 110.292 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.58 ' HB2' ' CG2' ' A' ' 457' ' ' THR . 2.0 mm-40 -108.51 132.23 54.03 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.125 -0.694 . . . . 74.24 109.125 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.458 HG22 ' O ' ' A' ' 508' ' ' GLN . 34.9 m -95.33 144.64 9.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 110.044 -0.354 . . . . 63.4 110.044 179.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 58.9 p -85.79 -2.59 58.38 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.81 0.338 . . . . 63.22 111.446 -177.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -124.04 133.16 53.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.334 -0.394 . . . . 73.11 110.222 -178.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -77.98 150.13 33.98 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.018 -0.364 . . . . 65.43 110.018 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 84.41 16.29 66.86 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.495 -0.859 . . . . 41.34 112.116 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.44 110.89 22.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.964 0.411 . . . . 72.01 110.535 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 529' ' ' THR . 27.2 mp0 -80.97 157.92 25.37 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.126 -0.694 . . . . 71.12 109.126 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.554 HG12 HG22 ' A' ' 529' ' ' THR . 24.5 m -128.1 143.16 41.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.246 0.546 . . . . 62.21 111.579 -175.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 21.5 ttmm -127.59 131.69 49.92 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.404 -0.816 . . . . 72.25 109.37 174.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . 0.462 ' HB2' HD11 ' A' ' 493' ' ' LEU . 98.0 m95 -98.17 115.91 29.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.303 0.573 . . . . 74.22 110.258 178.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 37.3 tp -116.63 120.89 40.08 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.342 -0.844 . . . . 73.22 109.501 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.473 ' HE2' ' HA3' ' A' ' 523' ' ' GLY . 13.3 tmtt? -109.44 106.65 16.49 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.466 -0.494 . . . . 73.4 110.311 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.08 38.31 20.36 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.164 -0.926 . . . . 73.3 111.808 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.73 -24.16 32.12 Favored Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.87 -0.681 . . . . 71.14 112.586 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.6 t -89.7 124.84 42.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 110.072 -0.344 . . . . 64.12 110.072 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -89.62 119.66 30.24 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.428 -0.582 . . . . 64.24 109.428 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.462 HD11 ' HB2' ' A' ' 486' ' ' TRP . 2.4 pp -72.73 161.64 30.49 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.199 -0.455 . . . . 65.12 111.395 -177.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . 0.5 ' O ' ' HB2' ' A' ' 497' ' ' GLU . 19.1 m -106.85 142.72 36.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.98 -0.554 . . . . 75.42 110.241 -178.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . 0.415 ' HD3' ' C ' ' A' ' 495' ' ' ARG . 4.3 tmt_? -65.19 -39.91 93.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.345 -0.613 . . . . 64.35 109.345 176.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . 0.439 ' H ' HG22 ' A' ' 494' ' ' THR . 1.3 mp0 -76.25 73.14 3.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.936 -0.575 . . . . 62.23 109.898 171.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . 0.5 ' HB2' ' O ' ' A' ' 494' ' ' THR . 5.0 tp10 -120.21 179.58 4.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.585 -0.734 . . . . 75.23 109.44 -177.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.426 ' H ' ' HG3' ' A' ' 497' ' ' GLU . 11.2 t -72.5 172.64 10.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.703 0.287 . . . . 72.55 110.345 175.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -79.13 18.21 0.68 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.816 0.341 . . . . 72.41 111.791 -173.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -61.4 -35.13 76.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 72.35 111.189 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.534 ' HD2' HD11 ' A' ' 512' ' ' LEU . 25.1 p90 -148.57 150.2 32.92 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.297 -0.411 . . . . 74.22 110.616 -177.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -146.6 142.64 28.16 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.479 -0.563 . . . . 72.45 109.479 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . 0.51 ' HB3' HD13 ' A' ' 512' ' ' LEU . 44.1 p90 -123.3 150.03 44.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.131 0.491 . . . . 74.33 111.34 -176.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -127.92 139.7 52.44 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.368 -0.833 . . . . 64.11 110.023 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.2 pptp? -111.07 137.78 48.3 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.691 -0.485 . . . . 75.43 109.691 173.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . 0.633 ' HB3' ' HB2' ' A' ' 509' ' ' ARG . 33.8 t70 -130.45 82.86 2.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.784 -0.644 . . . . 75.25 109.382 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.34 -107.99 2.25 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.704 -0.76 . . . . 65.34 111.661 -174.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.458 ' O ' HG22 ' A' ' 477' ' ' VAL . 15.9 pt20 -89.32 -7.44 55.33 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.454 0.645 . . . . 74.11 110.151 177.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.633 ' HB2' ' HB3' ' A' ' 506' ' ' ASP . 67.8 mtp180 -91.08 147.12 23.29 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.641 -0.709 . . . . 71.44 111.071 -172.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -141.72 115.72 9.29 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.36 -0.607 . . . . 75.32 109.36 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -124.33 122.51 37.91 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.68 0.276 . . . . 64.32 110.574 -175.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.534 HD11 ' HD2' ' A' ' 501' ' ' TYR . 57.4 tp -107.86 126.54 52.79 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.137 -0.483 . . . . 52.02 110.315 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.42 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.2 mp -108.76 113.84 45.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 120.954 0.406 . . . . 73.44 110.737 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . . . . . . . . . 35.5 mm -91.36 121.84 42.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.874 -0.787 . . . . 72.41 108.874 174.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . 0.447 HD22 ' N ' ' A' ' 515' ' ' ASN . 0.9 OUTLIER -66.64 -51.49 55.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.81 0.338 . . . . 72.24 110.397 -177.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . 0.445 ' HB3' ' HA2' ' A' ' 468' ' ' GLY . 46.4 mt-10 -145.4 123.55 12.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.917 -0.583 . . . . 72.45 110.131 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -66.48 133.71 50.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.128 -0.487 . . . . 50.34 110.999 178.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . 0.449 ' HG2' ' H ' ' A' ' 520' ' ' GLU . 55.1 ttm -113.67 155.96 24.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.891 -0.595 . . . . 75.44 109.621 -178.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.702 HD21 ' HB3' ' A' ' 542' ' ' GLU . 84.8 mt -58.81 -32.5 69.43 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.935 0.397 . . . . 51.24 111.623 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' A' ' 518' ' ' MET . 0.9 OUTLIER -60.41 -28.58 68.37 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.143 0.497 . . . . 74.01 110.691 178.454 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 523' ' ' GLY . 56.7 m-20 -71.32 -11.95 61.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.767 -0.651 . . . . 74.43 112.197 -175.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.489 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -61.66 5.54 0.08 Allowed 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.576 0.584 . . . . 72.02 112.576 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . 0.473 ' HA3' ' HE2' ' A' ' 488' ' ' LYS . . . -83.91 170.56 47.81 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 116.415 -0.357 . . . . 71.15 112.367 177.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 44.4 m-70 -73.69 118.56 16.79 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 122.65 -0.324 . . . . 72.21 110.559 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . 0.441 ' HB2' ' O ' ' A' ' 536' ' ' ALA . 56.8 m-85 -83.75 133.73 34.77 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.957 -0.386 . . . . 72.45 109.957 172.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.57 134.23 46.84 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.867 0.365 . . . . 70.14 110.514 175.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.548 HD11 ' HB ' ' A' ' 484' ' ' VAL . 57.1 tp -110.33 106.52 15.93 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.866 -0.606 . . . . 72.4 109.939 177.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 48.7 m -92.52 115.11 27.8 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.218 -0.446 . . . . 73.42 110.113 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.554 HG22 HG12 ' A' ' 484' ' ' VAL . 44.3 p -109.11 -175.01 2.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.909 0.385 . . . . 73.54 110.601 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 14.5 m -72.65 -5.92 40.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.082 -0.508 . . . . 74.32 110.965 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . 0.452 ' HA3' ' H ' ' A' ' 454' ' ' VAL . . . -138.43 -90.38 0.22 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.653 -0.784 . . . . 75.22 112.785 -178.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -97.46 127.28 9.16 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.631 -0.795 . . . . 51.2 112.455 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -95.55 127.1 41.31 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.059 0.457 . . . . 71.14 110.814 178.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -97.23 140.03 32.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.006 -0.543 . . . . 72.41 110.044 178.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 6.0 tt -129.58 123.78 32.18 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.724 -0.473 . . . . 75.3 109.724 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.441 ' O ' ' HB2' ' A' ' 525' ' ' TYR . . . -145.07 134.76 23.43 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.724 -0.671 . . . . 74.4 109.687 177.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . 0.438 ' H ' ' HG2' ' A' ' 537' ' ' GLU . 4.4 pt-20 -105.17 137.72 42.5 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 120.844 0.354 . . . . 73.02 110.474 -176.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 522' ' ' ALA . 45.4 tp -96.4 133.95 40.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.879 -0.601 . . . . 60.22 110.201 -174.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.834 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 7.6 mt -104.06 123.78 58.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.98 -0.748 . . . . 63.43 108.98 177.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 45.6 t -118.74 126.37 75.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.584 -0.28 . . . . 75.11 111.22 -174.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . 0.574 ' HG3' ' CD2' ' A' ' 464' ' ' LEU . 74.8 mt-30 -84.82 127.73 34.28 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 116.361 -0.381 . . . . 73.13 111.189 175.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . 0.702 ' HB3' HD21 ' A' ' 519' ' ' LEU . 6.9 pt-20 -91.12 126.81 36.32 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.512 -1.292 . . . . 74.22 107.512 163.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp . . . . . 0 C--N 1.315 -0.92 0 CA-C-O 118.865 -0.588 . . . . 62.24 109.736 -176.609 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo . . . . . 0 N--CA 1.462 -0.38 0 CA-C-O 120.797 0.249 . . . . 71.21 111.794 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.418 ' H ' ' HA3' ' A' ' 531' ' ' GLY . 43.1 t -66.26 106.34 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.112 -0.494 . . . . 63.41 110.219 -177.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 93.6 mt -82.57 147.29 28.7 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.605 -0.725 . . . . 73.41 110.163 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.788 HG13 ' HB2' ' A' ' 534' ' ' ALA . 40.7 mm -94.79 117.35 38.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.942 -0.572 . . . . 73.41 109.908 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . 0.496 HG22 ' NH2' ' A' ' 458' ' ' ARG . 3.3 m -83.28 -35.63 25.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.218 -0.447 . . . . 70.34 110.583 -177.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.717 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 14.2 mmp_? -115.42 105.57 52.04 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 109.566 -0.531 . . . . 74.12 109.566 176.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -70.75 160.61 48.85 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.784 2.323 . . . . 64.22 111.785 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.481 ' HB2' ' CB ' ' A' ' 536' ' ' ALA . 94.8 mt -81.77 169.4 16.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.763 0.316 . . . . 65.33 110.98 -177.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -64.7 118.12 8.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.961 -0.563 . . . . 43.13 111.444 -175.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -94.76 -11.75 28.43 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.865 -0.607 . . . . 72.42 111.503 177.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -89.51 159.73 17.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.196 0.522 . . . . 74.24 111.778 -171.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.41 HD23 ' C ' ' A' ' 464' ' ' LEU . 8.4 tt -85.81 137.06 33.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.51 -0.768 . . . . 74.32 110.258 -173.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.628 HG23 HG23 ' A' ' 540' ' ' VAL . 22.8 m -130.45 175.99 9.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.623 -0.717 . . . . 64.44 110.476 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . 0.493 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 65.8 mtt -111.21 150.74 29.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.638 0.256 . . . . 70.5 110.975 -178.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.5 142.56 16.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.303 -0.408 . . . . 41.43 110.72 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.06 -25.49 28.12 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.946 -0.645 . . . . 42.22 113.635 175.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 466' ' ' MET . 13.1 pt20 -89.26 164.82 14.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.25 0.525 . . . . 64.44 110.444 -178.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 514' ' ' ILE . 33.9 ttm180 -88.81 129.39 35.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.909 0.385 . . . . 71.55 111.215 -174.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -124.92 139.92 49.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.495 . . . . 72.11 110.206 -177.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -125.69 134.12 51.93 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.753 0.311 . . . . 55.42 110.643 -178.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.767 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 81.8 m-85 -107.12 116.32 31.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.207 -0.451 . . . . 70.04 110.625 177.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -100.06 118.14 35.81 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.628 -0.715 . . . . 71.24 109.606 177.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.717 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 27.6 t -134.89 141.29 46.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.299 0.571 . . . . 64.34 111.305 -178.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.621 ' HG3' ' HG2' ' A' ' 509' ' ' ARG . 42.7 tt0 -138.45 136.85 36.62 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.298 -1.001 . . . . 74.34 108.298 176.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.531 HG21 ' HB3' ' A' ' 482' ' ' ALA . 18.0 m -104.07 154.68 5.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 C-N-CA 121.167 -0.213 . . . . 64.22 110.459 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 45.4 m -82.61 -2.22 53.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.814 0.34 . . . . 74.21 111.622 -178.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -111.21 141.29 44.92 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.612 -0.514 . . . . 73.14 109.612 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -86.24 138.41 31.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.153 -0.476 . . . . 74.42 111.202 -173.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 62.13 39.1 97.2 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.922 -0.656 . . . . 65.43 112.212 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.531 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -103.34 112.03 24.72 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.078 0.466 . . . . 71.14 111.065 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -73.31 154.31 40.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.594 -0.73 . . . . 73.33 109.594 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.423 HG12 HG22 ' A' ' 529' ' ' THR . 35.7 m -124.63 161.26 28.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.897 0.379 . . . . 72.55 111.022 -175.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 527' ' ' LEU . 12.3 ttmm -116.64 128.77 55.69 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.731 -0.668 . . . . 44.45 109.682 177.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . 0.41 ' HB2' HD21 ' A' ' 493' ' ' LEU . 89.9 m95 -98.82 115.35 28.61 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.306 -0.627 . . . . 75.53 109.306 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 28.6 tp -119.6 119.2 33.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.032 -0.531 . . . . 63.11 110.393 -177.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.481 ' O ' ' HD3' ' A' ' 488' ' ' LYS . 13.3 tmtt? -109.74 106.79 16.56 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.013 -0.366 . . . . 71.33 110.013 177.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.1 t70 49.19 38.46 13.32 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.461 0.648 . . . . 74.21 111.491 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.45 -17.21 58.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.707 -0.759 . . . . 64.12 113.014 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.6 t -84.89 117.14 29.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.803 0.302 . . . . 74.34 110.729 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -97.89 117.67 32.75 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.44 -0.578 . . . . 53.53 109.44 176.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.41 HD21 ' HB2' ' A' ' 486' ' ' TRP . 1.9 pp -73.97 163.11 28.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.177 0.513 . . . . 73.54 112.008 -175.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 34.9 p -106.72 174.42 5.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.619 -0.719 . . . . 70.12 111.541 -177.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -63.14 -47.47 82.58 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.324 0.583 . . . . 75.22 111.202 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -95.52 50.51 1.24 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.824 -0.625 . . . . 74.33 110.23 -176.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -76.45 169.75 17.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.905 -0.589 . . . . 72.32 110.649 -176.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 4.7 t -57.75 150.97 18.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.155 0.502 . . . . 55.51 111.898 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -85.19 7.21 22.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.862 -0.608 . . . . 72.12 111.123 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . 0.485 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 54.3 tptt -62.06 -37.34 84.63 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.483 0.659 . . . . 75.0 109.337 174.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.519 ' HB2' HG12 ' A' ' 514' ' ' ILE . 8.4 p90 -152.19 131.64 12.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.954 -1.021 . . . . 71.54 108.681 175.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -139.0 161.51 37.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.096 0.474 . . . . 72.12 111.755 -175.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -119.0 139.64 51.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.834 -0.621 . . . . 70.35 110.755 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.427 ' HE2' ' HB3' ' A' ' 504' ' ' LYS . 40.7 mtpt -127.59 149.69 50.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.11 -0.495 . . . . 75.11 109.921 176.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.456 ' O ' ' HD3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -106.62 146.9 30.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.2 0.524 . . . . 73.32 111.478 -176.108 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -147.31 99.07 3.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.361 -0.836 . . . . 63.01 109.546 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 61.83 -123.65 32.16 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.453 -0.88 . . . . 51.25 111.107 -173.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -96.92 7.34 46.85 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.172 0.51 . . . . 74.43 110.423 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.621 ' HG2' ' HG3' ' A' ' 476' ' ' GLU . 74.8 mtm180 -95.26 152.29 18.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.044 -0.525 . . . . 60.32 110.032 177.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -136.94 128.25 28.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.966 -0.383 . . . . 50.33 109.966 -178.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -111.01 123.91 51.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.515 -0.311 . . . . 63.13 110.198 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.767 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 58.2 tp -110.28 104.47 13.28 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.511 -0.551 . . . . 45.3 109.511 174.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.432 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.3 mp -101.38 115.55 43.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.239 -0.437 . . . . 73.0 110.515 -175.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.527 ' O ' ' HG3' ' A' ' 470' ' ' ARG . 51.8 mt -97.74 119.42 45.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.898 -0.779 . . . . 75.54 108.898 173.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -69.1 -39.56 78.9 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.366 -0.379 . . . . 73.23 110.88 -177.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . 0.485 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 41.4 mt-10 -146.83 113.17 5.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.908 -0.587 . . . . 71.12 109.617 178.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -58.43 143.23 46.08 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 123.517 0.511 . . . . 71.13 111.385 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 88.0 mtp -123.38 172.9 8.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.102 -0.499 . . . . 64.02 110.301 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.477 HD13 ' O ' ' A' ' 519' ' ' LEU . 2.6 tm? -60.7 -31.36 70.64 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.956 -0.387 . . . . 65.54 109.956 177.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -52.44 -28.62 20.76 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.073 -0.512 . . . . 71.13 111.87 177.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . 0.556 ' HA ' ' HE1' ' A' ' 525' ' ' TYR . 42.6 m-20 -68.16 -15.38 63.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.379 -0.373 . . . . 73.03 111.802 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.52 ' HB2' HG12 ' A' ' 540' ' ' VAL . . . -71.04 -12.86 61.76 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.13 0.49 . . . . 73.15 110.225 174.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -77.66 156.53 44.6 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 111.138 -0.785 . . . . 30.53 111.138 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -81.79 117.19 21.89 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.189 0.518 . . . . 64.52 111.044 -176.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . 0.556 ' HE1' ' HA ' ' A' ' 521' ' ' ASP . 73.4 m-85 -88.96 133.76 34.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.205 -0.907 . . . . 74.24 110.667 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -123.59 135.02 53.74 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.081 -0.509 . . . . 73.25 110.36 176.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.434 ' HA ' ' O ' ' A' ' 485' ' ' LYS . 9.4 tt -109.8 111.0 22.17 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.883 -0.784 . . . . 74.13 108.883 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 42.1 t -109.5 136.31 49.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.29 -0.414 . . . . 71.2 110.721 -176.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.423 HG22 HG12 ' A' ' 484' ' ' VAL . 82.3 p -118.22 -175.65 2.9 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.69 -0.485 . . . . 73.4 109.69 175.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 13.7 m -69.18 -9.08 51.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.761 0.315 . . . . 74.31 110.942 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . 0.418 ' HA3' ' H ' ' A' ' 454' ' ' VAL . . . -124.85 -65.97 0.19 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.395 -0.907 . . . . 75.22 112.896 -177.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -113.52 171.45 13.84 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.676 -0.773 . . . . 61.1 112.498 -176.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -138.62 130.34 27.78 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.775 0.321 . . . . 71.1 110.561 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . 0.788 ' HB2' HG13 ' A' ' 456' ' ' ILE . . . -109.47 120.97 44.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.209 -0.451 . . . . 72.14 110.157 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 5.3 tt -109.05 121.2 44.64 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.093 -0.706 . . . . 64.23 109.093 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.481 ' CB ' ' HB2' ' A' ' 460' ' ' LEU . . . -119.2 132.13 55.91 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.065 0.46 . . . . 73.33 110.478 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -99.46 108.73 21.26 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.38 0.61 . . . . 73.43 109.691 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.453 HD23 ' HB3' ' A' ' 521' ' ' ASP . 37.0 tp -97.78 136.1 38.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.331 -0.85 . . . . 75.2 109.459 -177.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 31.5 mt -113.03 112.36 40.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.84 -0.43 . . . . 63.25 109.84 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.628 HG23 HG23 ' A' ' 465' ' ' VAL . 4.4 p -113.91 133.34 60.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 108.803 -0.814 . . . . 73.25 108.803 176.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -110.21 148.18 32.34 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.107 0.479 . . . . 73.4 111.407 -176.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.36 146.97 50.1 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.012 -0.994 . . . . 60.11 110.786 -178.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . 0.46 ' HD2' ' HB3' ' A' ' 466' ' ' MET . 55.9 mtpt . . . . . 0 C--O 1.244 0.803 0 CA-C-O 118.629 -0.7 . . . . 72.24 109.323 175.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo . . . . . 0 N--CA 1.464 -0.247 0 CA-C-O 120.956 0.315 . . . . 51.43 112.068 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.68 132.35 32.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.991 -0.55 . . . . 74.11 110.674 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.9 137.26 34.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.922 -0.581 . . . . 73.52 110.857 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.566 HD13 HG12 ' A' ' 477' ' ' VAL . 32.9 mm -95.43 119.08 43.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.734 -0.666 . . . . 73.34 109.717 177.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . 0.783 ' HB ' ' HG3' ' A' ' 476' ' ' GLU . 7.5 m -86.89 -23.54 25.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 73.21 111.18 -177.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.824 ' HG2' ' HG2' ' A' ' 476' ' ' GLU . 22.5 mmt180 -123.35 117.32 28.04 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.598 -0.274 . . . . 65.33 111.671 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -83.42 167.12 13.71 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 123.02 2.48 . . . . 75.42 111.414 173.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -89.49 169.96 10.92 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.617 0.246 . . . . 40.33 110.87 -178.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -71.18 118.64 14.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.275 -0.42 . . . . 65.21 110.453 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -93.94 -13.47 27.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.171 -0.468 . . . . 64.02 111.27 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -89.66 155.32 19.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.136 0.493 . . . . 62.01 111.131 -173.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 8.0 tt -88.95 133.13 34.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.708 -0.678 . . . . 70.32 110.352 -173.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 28.7 m -127.49 176.67 6.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 63.21 111.035 -177.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 26.4 mmt -113.86 152.91 30.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.323 -0.399 . . . . 75.41 111.272 -176.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . 0.408 HG13 ' O ' ' A' ' 517' ' ' ALA . 83.1 t -68.14 144.69 14.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.549 -0.751 . . . . 71.01 110.787 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.52 -2.26 53.39 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.911 -0.661 . . . . 45.24 113.973 175.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -114.57 164.34 14.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.471 0.636 . . . . 54.02 110.475 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 27.2 ttt85 -84.92 132.88 34.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.975 0.417 . . . . 74.54 111.166 -177.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.494 ' O ' ' HB ' ' A' ' 514' ' ' ILE . 50.5 t -131.67 138.57 52.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.862 -0.608 . . . . 52.42 109.605 177.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -131.78 139.44 48.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.778 0.323 . . . . 64.22 110.461 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.461 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 93.5 m-85 -121.27 109.61 15.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.929 -0.578 . . . . 64.41 110.154 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -106.43 117.09 33.13 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 119.909 -0.716 . . . . 62.42 109.467 173.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.768 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 7.7 p -122.8 123.41 40.98 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.555 -0.748 . . . . 62.11 109.974 -178.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.824 ' HG2' ' HG2' ' A' ' 458' ' ' ARG . 13.3 pt-20 -125.42 145.09 50.22 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.909 0.385 . . . . 74.43 110.239 -177.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.566 HG12 HD13 ' A' ' 456' ' ' ILE . 17.9 m -111.49 164.63 7.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.782 -0.645 . . . . 71.32 109.543 178.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 15.6 t -78.16 -18.0 56.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.728 0.299 . . . . 74.14 111.214 -178.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . 0.41 ' O ' HG23 ' A' ' 477' ' ' VAL . 44.6 tt0 -103.31 131.94 49.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.817 0.341 . . . . 72.14 110.422 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . 0.517 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 43.2 tt0 -89.17 131.56 35.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.854 0.359 . . . . 60.51 110.164 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 98.78 -1.42 58.14 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.801 -0.714 . . . . 54.13 111.523 -176.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.536 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -79.57 112.01 16.41 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.055 0.455 . . . . 74.33 110.625 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -81.78 147.15 29.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.647 -0.706 . . . . 75.25 110.805 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 28.9 m -126.96 153.24 35.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.006 -0.543 . . . . 65.5 110.459 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -119.23 145.72 45.82 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.644 -0.502 . . . . 71.23 109.644 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -98.6 129.37 45.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.305 0.574 . . . . 74.51 110.909 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . 0.648 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 2.6 tm? -116.24 131.73 56.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.277 -0.874 . . . . 75.33 108.846 -177.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.437 ' HE3' ' HA3' ' A' ' 523' ' ' GLY . 1.2 tmtp? -120.55 107.32 12.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.898 0.38 . . . . 70.01 111.446 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 53.72 37.72 26.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.379 -0.828 . . . . 62.24 111.993 172.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.99 -24.04 33.01 Favored Glycine 0 CA--C 1.517 0.196 0 C-N-CA 120.751 -0.738 . . . . 63.14 112.553 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.9 t -97.28 127.87 49.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.725 0.298 . . . . 44.32 110.417 -178.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -86.65 131.85 34.04 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.82 -0.437 . . . . 63.2 109.82 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 3.3 pp -112.14 162.96 14.86 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.072 0.463 . . . . 51.14 111.256 -177.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 22.2 p -108.19 173.91 6.11 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.906 -0.588 . . . . 61.22 109.701 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . 0.639 ' HD3' ' CE2' ' A' ' 503' ' ' PHE . 13.9 tpt180 -80.9 -4.41 54.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.077 0.465 . . . . 63.33 110.467 -178.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -74.07 75.69 1.74 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.193 0.52 . . . . 73.53 110.48 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -145.47 170.7 15.87 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.824 -0.625 . . . . 74.41 109.482 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.436 HG23 ' H ' ' A' ' 500' ' ' LYS . 15.2 t -68.65 172.12 6.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.086 0.47 . . . . 63.32 111.235 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -84.7 18.53 2.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 75.45 111.931 -172.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . 0.436 ' H ' HG23 ' A' ' 498' ' ' THR . 13.8 tmtt? -58.09 -32.43 68.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.464 0.649 . . . . 72.11 109.785 174.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.621 ' HD2' HD11 ' A' ' 512' ' ' LEU . 23.0 p90 -144.44 144.11 31.23 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.467 -0.788 . . . . 65.55 109.153 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 22.2 p-90 -147.33 145.44 29.33 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.384 -0.371 . . . . 72.35 110.001 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . 0.639 ' CE2' ' HD3' ' A' ' 495' ' ' ARG . 44.9 p90 -126.87 151.99 47.64 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.327 -0.549 . . . . 63.55 111.651 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.539 ' NZ ' ' HB3' ' A' ' 504' ' ' LYS . 8.9 mtpm? -116.23 150.11 38.07 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.344 -0.844 . . . . 73.34 110.785 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 505' ' ' LYS . 18.5 ptpt -110.62 106.93 16.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.283 0.563 . . . . 74.54 109.804 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . 0.584 ' HB2' ' HG3' ' A' ' 509' ' ' ARG . 5.5 m-20 -113.82 80.3 1.36 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.23 0.538 . . . . 73.51 109.883 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.73 -96.7 0.38 Allowed Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.579 -0.737 . . . . 52.25 112.495 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.517 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 19.2 pt20 -108.09 -10.83 15.39 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.918 0.39 . . . . 73.34 111.365 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.584 ' HG3' ' HB2' ' A' ' 506' ' ' ASP . 5.2 ptp180 -102.74 136.3 42.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.112 0.482 . . . . 74.25 110.528 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 -120.51 122.26 40.24 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.345 -0.613 . . . . 72.21 109.345 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . 0.501 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 12.8 m-70 -109.95 121.64 45.72 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 121.141 -0.223 . . . . 72.2 110.604 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.621 HD11 ' HD2' ' A' ' 501' ' ' TYR . 67.9 tp -106.93 110.62 22.82 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.45 -0.574 . . . . 74.51 109.45 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.413 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.1 mp -100.84 119.85 49.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.238 -0.437 . . . . 75.52 110.145 -178.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.494 ' HB ' ' O ' ' A' ' 471' ' ' VAL . 69.0 mt -106.91 121.27 59.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.395 -0.594 . . . . 74.44 109.395 174.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -64.96 -51.65 60.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.172 -0.467 . . . . 74.03 110.227 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . 0.432 ' O ' ' HE2' ' A' ' 500' ' ' LYS . 42.0 mt-10 -139.39 129.7 25.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.986 -0.552 . . . . 75.44 110.157 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.408 ' O ' HG13 ' A' ' 467' ' ' VAL . . . -64.04 132.44 50.57 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.966 -0.383 . . . . 71.11 109.966 175.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 49.7 ttm -128.6 171.85 11.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.926 -0.579 . . . . 60.41 109.625 -174.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 9.4 mp -54.87 -31.77 60.07 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.188 0.44 . . . . 62.23 112.188 -178.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -65.33 -21.45 66.7 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.485 0.55 . . . . 75.44 112.485 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -75.39 -14.56 60.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.888 0.375 . . . . 72.31 110.938 -178.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.431 ' HA ' ' H ' ' A' ' 540' ' ' VAL . . . -64.4 -20.97 66.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.2 -0.455 . . . . 50.25 109.935 173.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . 0.437 ' HA3' ' HE3' ' A' ' 488' ' ' LYS . . . -66.06 120.65 16.65 Favored Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 110.825 -0.91 . . . . 51.34 110.825 173.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -64.09 106.93 1.15 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.089 0.471 . . . . 64.33 110.956 -172.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . 0.416 ' HA ' ' O ' ' A' ' 487' ' ' LEU . 96.9 m-85 -75.09 135.03 41.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.416 -0.811 . . . . 73.12 111.459 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.648 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -126.07 139.57 53.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.559 -0.746 . . . . 75.15 109.678 175.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 37.5 tp -97.97 107.1 19.51 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.894 -0.409 . . . . 64.11 109.894 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 53.2 m -91.7 114.01 26.43 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.17 -0.468 . . . . 71.42 110.368 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 3.2 m -119.2 163.4 17.14 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.872 -0.604 . . . . 64.24 109.915 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 26.0 t -72.64 -5.29 36.42 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 111.769 0.285 . . . . 64.44 111.769 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -119.83 -105.7 2.11 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.562 -0.828 . . . . 75.25 111.701 177.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -91.02 124.24 7.47 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.902 -0.879 . . . . 62.32 110.902 174.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.13 141.57 28.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.952 0.406 . . . . 70.44 110.241 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -103.62 125.11 49.93 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.115 -0.493 . . . . 74.12 110.365 -178.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 5.2 tt -128.34 121.43 29.15 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.25 0.548 . . . . 74.23 110.294 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -135.0 141.26 46.17 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.458 -0.942 . . . . 74.42 108.458 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -96.43 109.7 22.19 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.044 0.926 . . . . 75.34 110.543 -174.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 54.8 tp -95.76 136.75 35.78 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.641 -1.163 . . . . 51.22 109.733 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 55.8 mt -126.08 118.87 52.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.992 -0.549 . . . . 72.31 109.649 177.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.431 ' H ' ' HA ' ' A' ' 522' ' ' ALA . 40.9 t -114.44 105.41 18.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 109.699 -0.482 . . . . 65.44 109.699 179.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . 0.432 HE21 HD11 ' A' ' 464' ' ' LEU . 76.5 mt-30 -87.36 139.29 30.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.852 -0.613 . . . . 75.31 110.864 -176.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . 0.41 ' H ' ' CD ' ' A' ' 542' ' ' GLU . 1.0 OUTLIER -86.47 155.99 20.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.456 -0.793 . . . . 63.01 110.679 -178.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . 0.401 ' HE3' ' HB3' ' A' ' 543' ' ' LYS . 26.3 mtpp . . . . . 0 C--O 1.248 1.011 0 CA-C-N 115.904 -0.589 . . . . 73.54 109.673 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . 0.463 ' O ' HD22 ' A' ' 455' ' ' LEU . 35.1 Cg_exo . . . . . 0 N--CA 1.466 -0.139 0 N-CA-C 110.931 -0.45 . . . . 73.52 110.931 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 56.5 t -65.98 113.32 2.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.932 -0.307 . . . . 71.4 110.341 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . 0.463 HD22 ' O ' ' A' ' 453' ' ' PRO . 2.6 mm? -78.62 125.22 29.07 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.113 -0.494 . . . . 70.23 111.084 -176.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 36.5 mm -81.96 106.34 12.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.064 -0.717 . . . . 64.34 109.064 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 86.1 m -62.02 -39.54 92.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.105 -0.498 . . . . 74.33 111.491 -175.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -128.63 121.84 21.36 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.445 -0.343 . . . . 64.14 110.532 -179.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.49 167.88 23.64 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.932 2.422 . . . . 70.4 112.398 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . 0.482 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 97.0 mt -80.89 147.38 30.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 74.44 110.586 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -55.67 122.25 10.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.451 -0.795 . . . . 63.44 111.721 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -93.18 -11.09 33.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.238 -0.892 . . . . 63.4 112.054 -176.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -88.05 157.42 18.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.473 0.654 . . . . 74.11 111.882 -169.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 9.0 tt -86.84 142.3 28.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.016 -0.993 . . . . 72.03 110.534 -173.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 27.7 m -130.18 178.17 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 CA-C-N 115.936 -0.575 . . . . 72.5 110.823 -178.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . 0.417 ' H ' HE21 ' A' ' 469' ' ' GLN . 21.0 ptp -127.24 160.28 31.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.965 0.412 . . . . 75.33 111.531 -178.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.63 146.25 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.188 -0.914 . . . . 62.42 112.45 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 102.02 -7.79 55.2 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 121.084 -0.579 . . . . 45.13 114.136 171.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.417 HE21 ' H ' ' A' ' 466' ' ' MET . 30.2 pt20 -112.51 167.71 10.23 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 122.268 -0.548 . . . . 64.55 110.323 178.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.98 141.34 29.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.976 -0.749 . . . . 65.31 108.976 176.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.731 HG23 ' HB ' ' A' ' 514' ' ' ILE . 6.8 m -127.96 123.38 60.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 121.294 0.569 . . . . 54.01 110.01 176.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -121.93 123.96 42.94 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.303 0.573 . . . . 73.15 110.577 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -114.06 132.67 55.94 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.234 -0.894 . . . . 75.11 109.615 -175.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -120.32 116.91 26.47 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.46 -0.496 . . . . 73.12 110.669 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.666 ' O ' ' HB2' ' A' ' 510' ' ' HIS . 5.9 p -139.26 110.95 7.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.726 -0.67 . . . . 54.41 109.974 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.602 ' HB3' ' H ' ' A' ' 510' ' ' HIS . 0.6 OUTLIER -128.92 163.27 25.66 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.238 -0.437 . . . . 73.44 110.343 -178.644 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.513 HG21 ' HB3' ' A' ' 482' ' ' ALA . 17.7 m -113.67 171.91 3.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.25 -0.432 . . . . 72.21 110.874 -173.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 20.2 t -88.79 -22.28 23.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.043 -0.526 . . . . 70.45 110.854 -177.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -96.75 132.51 42.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.632 -0.507 . . . . 75.24 109.632 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . 0.651 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 11.4 pt-20 -87.47 137.54 32.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.108 0.48 . . . . 74.31 111.012 -175.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 95.58 -6.97 68.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.831 -0.699 . . . . 55.3 111.959 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.513 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -77.97 110.71 13.14 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.121 0.486 . . . . 74.3 110.187 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -92.8 164.88 13.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.822 -0.626 . . . . 62.42 110.508 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.489 HG12 HG23 ' A' ' 529' ' ' THR . 35.5 m -135.95 154.82 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.208 -0.451 . . . . 71.31 110.345 -178.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -117.42 138.71 51.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.769 -0.456 . . . . 74.5 109.769 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . 0.587 ' HB2' HD21 ' A' ' 493' ' ' LEU . 87.6 m95 -99.34 138.12 36.87 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.045 0.45 . . . . 72.0 111.217 -176.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 34.5 tp -121.84 128.99 52.27 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.259 -0.645 . . . . 72.14 109.259 176.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -112.36 106.68 15.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.004 0.431 . . . . 70.02 110.909 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.1 t70 53.63 36.82 24.56 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.447 -0.797 . . . . 73.34 111.625 174.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 94.15 -21.02 44.49 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.771 -0.728 . . . . 62.4 112.669 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 61.6 t -99.77 133.07 43.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 110.099 -0.334 . . . . 74.32 110.099 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -78.81 125.61 29.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.868 -0.79 . . . . 63.12 108.868 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.587 HD21 ' HB2' ' A' ' 486' ' ' TRP . 3.2 pp -68.73 161.82 27.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.382 0.61 . . . . 71.42 112.098 -170.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 6.6 t -107.4 172.88 6.58 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.126 -0.943 . . . . 52.53 110.903 -172.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -104.64 7.62 35.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.224 0.535 . . . . 75.11 110.274 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -62.11 -69.44 0.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.876 -0.602 . . . . 71.12 111.417 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . 0.538 ' OE2' ' HB2' ' A' ' 500' ' ' LYS . 25.7 tt0 -106.68 118.89 37.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.116 0.484 . . . . 72.32 110.477 178.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.605 HG22 ' HB3' ' A' ' 502' ' ' TRP . 3.9 m -111.27 11.69 21.7 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.629 0.728 . . . . 71.43 109.686 175.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . 0.502 ' H ' ' HG2' ' A' ' 497' ' ' GLU . 89.3 m-85 -83.81 -25.51 30.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.639 -0.71 . . . . 72.34 111.249 -176.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . 0.538 ' HB2' ' OE2' ' A' ' 497' ' ' GLU . 4.6 ttmp? -69.69 -42.43 74.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.113 0.483 . . . . 72.44 110.017 177.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.505 ' HB2' HG12 ' A' ' 514' ' ' ILE . 7.5 p90 -159.0 142.2 14.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.499 -0.773 . . . . 63.34 110.164 -178.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 502' ' ' TRP . . . . . 0.605 ' HB3' HG22 ' A' ' 498' ' ' THR . 0.1 OUTLIER -140.78 145.59 36.55 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.201 -0.454 . . . . 74.33 110.991 178.478 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . 0.472 ' HB3' HD13 ' A' ' 512' ' ' LEU . 31.2 p90 -117.77 151.69 36.8 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.21 -0.45 . . . . 74.25 109.925 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -115.52 135.44 54.09 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.981 -0.554 . . . . 73.14 109.787 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 1.9 pptp? -104.49 132.71 50.42 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.856 -0.424 . . . . 72.52 109.856 172.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . 0.686 ' HB3' ' HB2' ' A' ' 509' ' ' ARG . 8.0 t70 -143.2 84.38 1.82 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.168 -0.469 . . . . 73.31 109.865 -177.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.31 -97.61 0.34 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.032 -0.604 . . . . 74.15 111.854 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.651 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 19.1 pt20 -105.55 -7.69 18.46 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.328 0.585 . . . . 73.24 110.315 176.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.686 ' HB2' ' HB3' ' A' ' 506' ' ' ASP . 58.2 mtt180 -84.66 139.87 31.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.415 -0.811 . . . . 73.41 110.807 -175.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . 0.666 ' HB2' ' O ' ' A' ' 475' ' ' CYS . 95.2 m-70 -141.77 116.99 10.07 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.414 -0.587 . . . . 73.14 109.414 174.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 19.8 m-70 -125.75 122.88 37.5 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.93 -0.396 . . . . 75.35 109.93 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 503' ' ' PHE . 54.0 tp -107.39 120.14 41.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.861 0.362 . . . . 54.43 110.513 -176.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 60.5 mt -115.06 114.51 46.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 116.504 -0.316 . . . . 52.45 110.556 -178.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.731 ' HB ' HG23 ' A' ' 471' ' ' VAL . 58.5 mt -100.59 119.86 49.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.196 0.522 . . . . 71.2 109.598 176.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -70.75 -37.71 73.44 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.359 -0.837 . . . . 64.45 111.935 -173.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -138.63 111.07 7.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.598 -0.274 . . . . 74.32 111.296 -177.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -67.29 122.35 17.69 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.679 -0.489 . . . . 64.43 109.679 173.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 93.9 mmm -135.04 175.21 9.79 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.886 -0.597 . . . . 74.22 110.548 -174.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.83 -33.76 74.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.858 0.361 . . . . 72.4 110.77 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -62.85 -26.56 68.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.224 0.535 . . . . 73.23 111.071 173.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -83.2 -14.89 52.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.423 -0.808 . . . . 70.32 110.151 -177.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -76.31 5.61 6.79 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.795 -0.638 . . . . 52.21 111.202 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -70.64 158.14 53.61 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.908 -0.663 . . . . 64.21 111.607 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -83.3 114.16 21.21 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 122.048 -0.678 . . . . 72.1 109.999 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -88.37 132.97 34.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.149 0.5 . . . . 61.54 111.503 -174.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.615 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -122.69 142.92 50.16 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.607 -0.724 . . . . 72.03 109.702 175.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.713 ' HB3' ' HB3' ' A' ' 534' ' ' ALA . 10.0 tt -121.13 117.92 28.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.986 0.422 . . . . 44.05 109.999 -176.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 55.9 m -99.23 124.02 43.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.01 -0.541 . . . . 72.21 110.482 -179.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.503 ' HB ' ' H ' ' A' ' 532' ' ' GLY . 2.3 m -113.78 166.13 11.86 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.168 -0.308 . . . . 74.44 110.168 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 9.5 m -54.83 -36.32 64.89 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.807 0.337 . . . . 70.42 111.83 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -136.43 -6.77 1.79 Allowed Glycine 0 C--O 1.227 -0.304 0 C-N-CA 120.476 -0.869 . . . . 74.33 112.716 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . 0.503 ' H ' ' HB ' ' A' ' 529' ' ' THR . . . -115.34 173.27 14.64 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.828 -0.701 . . . . 52.55 112.266 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -146.68 137.63 24.08 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.917 -0.401 . . . . 72.44 109.917 177.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . 0.713 ' HB3' ' HB3' ' A' ' 527' ' ' LEU . . . -132.65 148.55 52.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.405 -0.361 . . . . 62.45 110.501 178.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 7.7 tt -144.62 131.28 20.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.609 -0.886 . . . . 63.52 108.609 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . 0.482 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -135.13 137.44 42.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.157 0.503 . . . . 51.31 110.757 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -99.68 109.09 21.58 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.994 -0.548 . . . . 75.03 109.846 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 52.7 tp -104.23 115.87 31.18 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.731 -0.668 . . . . 54.33 109.792 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.436 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 54.6 mt -105.65 112.37 38.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 109.769 -0.456 . . . . 74.24 109.769 177.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 36.3 t -102.97 102.37 13.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 116.043 -0.526 . . . . 71.51 109.75 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -85.36 145.74 27.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.029 -0.532 . . . . 73.42 111.145 -176.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -81.05 153.77 27.2 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.313 -0.625 . . . . 74.2 109.313 172.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.337 -0.839 . . . . 53.31 110.085 -178.099 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo . . . . . 0 N--CA 1.463 -0.291 0 CA-C-O 120.881 0.284 . . . . 52.5 111.701 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.69 114.72 3.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.199 -0.455 . . . . 63.42 110.275 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 93.4 mt -78.98 142.95 36.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.856 -0.611 . . . . 71.22 110.995 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.414 HD13 HG12 ' A' ' 477' ' ' VAL . 31.0 mm -96.84 119.24 44.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.617 -0.72 . . . . 40.32 109.93 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 31.6 p -92.45 -31.7 15.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.022 0.439 . . . . 74.31 111.597 -178.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.753 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 18.5 mmt180 -101.18 121.63 51.28 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.284 -0.417 . . . . 74.5 110.638 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -86.78 161.27 9.11 Favored 'Trans proline' 0 N--CA 1.45 -1.049 0 C-N-CA 122.077 1.851 . . . . 64.44 112.176 175.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -83.3 172.32 12.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.008 -0.542 . . . . 42.34 110.062 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . 0.868 ' HG3' HD13 ' A' ' 538' ' ' LEU . 4.7 pm0 -56.99 118.21 4.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.818 0.818 . . . . 73.14 112.856 -172.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -95.28 -19.1 20.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.48 -0.782 . . . . 73.33 110.302 172.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -92.16 154.72 18.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 75.23 111.605 -174.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.705 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 3.2 tt -90.12 134.86 34.01 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.021 -0.733 . . . . 73.03 109.021 176.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.483 ' N ' HD23 ' A' ' 464' ' ' LEU . 35.8 m -120.8 160.98 21.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.176 0.513 . . . . 73.41 111.778 -174.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . 0.441 ' SD ' ' HD3' ' A' ' 543' ' ' LYS . 23.1 ptp -98.85 153.37 18.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 74.11 110.582 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . 0.46 ' CG1' ' HA ' ' A' ' 542' ' ' GLU . 14.3 p -69.01 145.21 13.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 72.25 111.246 177.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 100.5 -24.74 30.92 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.778 -0.725 . . . . 44.21 113.7 172.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.437 HE21 ' HB ' ' A' ' 465' ' ' VAL . 26.5 pt20 -85.81 162.0 18.86 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 117.191 0.496 . . . . 71.01 110.916 -177.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -86.27 116.8 24.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.962 -0.563 . . . . 70.43 109.778 176.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 22.0 t -117.23 126.74 74.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 110.037 -0.357 . . . . 52.55 110.037 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.505 ' HG2' HG23 ' A' ' 513' ' ' ILE . 41.2 mt-10 -109.07 123.47 49.22 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.447 -0.342 . . . . 74.03 110.201 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.591 ' CE1' ' HB3' ' A' ' 461' ' ' GLU . 25.3 m-85 -106.85 109.08 20.89 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.415 -0.587 . . . . 71.35 109.415 177.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' A' ' 458' ' ' ARG . 29.5 mt-10 -106.58 116.73 32.44 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.701 -0.481 . . . . 64.23 109.701 -178.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.753 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 36.8 t -135.69 111.81 9.65 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.227 0.537 . . . . 73.52 110.07 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.627 ' HB3' ' H ' ' A' ' 510' ' ' HIS . 7.3 pt-20 -131.05 167.67 18.69 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.776 -0.647 . . . . 72.53 109.897 -176.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.663 HG21 ' HB3' ' A' ' 482' ' ' ALA . 20.9 m -115.06 166.94 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.932 0.396 . . . . 75.13 111.59 -172.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 41.2 t -86.34 -11.08 53.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.73 -0.668 . . . . 73.11 111.695 -176.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -116.22 139.72 50.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.903 0.382 . . . . 71.01 111.208 -175.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . 0.637 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 7.7 tp10 -75.49 146.83 40.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.65 -0.705 . . . . 72.1 110.79 -177.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 82.43 -8.76 60.58 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 116.018 -0.537 . . . . 73.04 112.977 177.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.663 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -74.72 116.26 15.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.418 0.627 . . . . 71.2 111.484 -176.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -82.31 156.05 24.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.115 -0.948 . . . . 72.12 110.327 178.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 26.8 m -129.27 154.36 40.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.322 -0.399 . . . . 73.41 110.726 -178.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 57.3 tttp -118.49 134.93 54.69 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.871 -0.604 . . . . 63.43 110.076 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -98.23 122.06 40.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.069 0.461 . . . . 64.32 110.582 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 24.4 tp -120.12 125.35 48.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.654 -0.703 . . . . 64.52 109.53 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.552 ' HD2' HD21 ' A' ' 493' ' ' LEU . 26.1 tttp -101.65 103.65 14.46 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.762 -0.458 . . . . 64.23 109.762 -177.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.6 t0 45.81 38.23 4.16 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.781 0.832 . . . . 73.33 112.518 -179.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 93.02 -4.75 75.17 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.542 -0.837 . . . . 54.23 112.711 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 54.3 t -99.85 127.32 52.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.947 -0.39 . . . . 54.14 109.947 176.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -72.95 124.56 25.69 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.066 -0.515 . . . . 62.21 110.598 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.552 HD21 ' HD2' ' A' ' 488' ' ' LYS . 86.0 mt -76.49 148.54 37.11 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.135 -0.484 . . . . 63.01 110.787 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 7.8 t -93.48 165.47 12.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.901 -0.59 . . . . 73.51 110.771 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -65.61 -29.07 69.61 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.061 0.458 . . . . 73.51 110.677 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -108.77 80.77 1.37 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.3 0.572 . . . . 74.24 110.506 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -96.52 161.32 13.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.354 -0.839 . . . . 73.52 109.888 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 11.2 t -63.29 151.86 39.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.058 0.456 . . . . 62.3 110.962 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -85.23 16.97 3.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.098 -0.501 . . . . 72.11 111.12 -176.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . 0.7 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 33.3 tttp -71.66 -28.06 63.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.482 -0.562 . . . . 74.34 109.482 177.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.554 ' HB3' HG23 ' A' ' 514' ' ' ILE . 2.2 p90 -142.82 135.01 27.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.661 -0.7 . . . . 73.31 110.101 173.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 502' ' ' TRP . . . . . 0.488 ' CZ3' ' HE3' ' A' ' 504' ' ' LYS . 11.4 p-90 -139.17 166.51 24.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.513 -0.767 . . . . 75.02 109.705 -172.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -133.58 157.46 45.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.438 0.637 . . . . 64.25 112.403 -175.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.488 ' HE3' ' CZ3' ' A' ' 502' ' ' TRP . 99.7 mttt -118.21 150.73 38.93 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.549 -1.205 . . . . 73.33 108.913 174.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.4 pptp? -137.94 129.87 28.59 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.348 0.594 . . . . 72.34 111.208 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . 0.652 ' HB2' ' HB2' ' A' ' 509' ' ' ARG . 26.9 m-20 -119.56 79.5 1.44 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.58 -0.896 . . . . 50.31 108.58 173.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 60.33 -104.44 0.62 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.92 -0.657 . . . . 74.53 112.402 -175.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.637 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 20.7 pt20 -80.39 -16.38 54.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.995 0.426 . . . . 75.12 110.734 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.652 ' HB2' ' HB2' ' A' ' 506' ' ' ASP . 84.8 mtt180 -84.71 132.02 34.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.126 -0.488 . . . . 63.54 110.12 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . 0.627 ' H ' ' HB3' ' A' ' 476' ' ' GLU . 77.9 m-70 -136.14 117.11 14.25 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.38 -0.6 . . . . 72.35 109.38 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -125.63 121.71 34.32 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 121.034 -0.266 . . . . 62.41 110.498 -175.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . 0.409 ' HB3' ' O ' ' A' ' 473' ' ' PHE . 37.7 tp -103.61 133.11 49.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.717 0.294 . . . . 61.33 110.435 -178.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.505 HG23 ' HG2' ' A' ' 472' ' ' GLU . 4.7 mp -121.19 116.85 50.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 110.083 -0.34 . . . . 60.12 110.083 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.554 HG23 ' HB3' ' A' ' 501' ' ' TYR . 46.9 mt -97.49 120.56 46.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.399 -0.593 . . . . 75.41 109.399 175.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -69.06 -41.06 78.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.006 0.432 . . . . 75.15 110.483 -177.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . 0.7 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 34.2 mt-10 -137.47 107.95 6.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.94 -0.573 . . . . 73.42 110.407 -178.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -65.26 122.59 17.46 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.264 -0.643 . . . . 52.23 109.264 174.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . 0.497 ' HG3' ' HG2' ' A' ' 520' ' ' GLU . 11.9 tpt -125.83 157.1 38.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.667 0.27 . . . . 75.43 110.858 -172.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.93 -38.14 84.76 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.231 -0.441 . . . . 73.23 111.397 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . 0.497 ' HG2' ' HG3' ' A' ' 518' ' ' MET . 10.4 pt-20 -70.15 -22.35 62.99 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.222 0.534 . . . . 75.3 110.832 178.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -88.09 -13.29 41.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.707 -0.679 . . . . 73.43 110.392 -176.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.524 ' HB2' ' HB ' ' A' ' 540' ' ' VAL . . . -63.0 6.19 0.11 Allowed 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.723 1.009 . . . . 74.24 113.723 -174.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -59.67 137.03 50.01 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.273 -0.731 . . . . 72.15 111.273 175.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -60.94 126.48 27.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.356 -0.238 . . . . 52.25 110.356 -175.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -84.95 131.15 34.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.83 0.824 . . . . 73.25 112.19 -174.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.1 135.79 48.62 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.765 -1.107 . . . . 52.33 109.837 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 9.9 tt -122.32 122.99 40.36 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.68 -0.489 . . . . 61.31 109.68 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 57.6 m -103.61 124.55 49.02 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.983 -0.553 . . . . 75.52 110.598 -177.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.478 HG21 HG11 ' A' ' 477' ' ' VAL . 14.3 m -117.56 166.59 12.2 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.344 -0.613 . . . . 73.13 109.344 176.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . 0.429 ' N ' HG22 ' A' ' 529' ' ' THR . 22.9 t -66.68 -11.24 53.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.82 0.343 . . . . 72.14 110.699 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -99.52 -83.6 1.74 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.0 -0.619 . . . . 71.44 112.05 177.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -114.02 166.96 12.2 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.7 -0.762 . . . . 63.23 112.24 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -109.92 122.71 48.18 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.802 -0.444 . . . . 62.44 109.802 177.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -103.2 135.12 45.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.46 -0.336 . . . . 44.24 110.431 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 8.3 tt -146.05 136.69 24.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.892 -0.41 . . . . 63.23 109.892 -178.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -143.5 155.27 44.29 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.278 -0.419 . . . . 72.44 109.945 178.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -96.54 112.06 23.95 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.4 0.619 . . . . 64.43 111.225 -177.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.868 HD13 ' HG3' ' A' ' 461' ' ' GLU . 62.8 tp -94.52 136.45 34.81 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.668 -0.697 . . . . 64.2 110.115 177.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.705 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 65.3 mt -133.15 134.03 57.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.848 -0.797 . . . . 75.01 108.848 175.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.524 ' HB ' ' HB2' ' A' ' 522' ' ' ALA . 98.4 t -122.84 116.28 48.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 110.021 -0.362 . . . . 70.21 110.021 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . 0.635 ' HG3' HD21 ' A' ' 464' ' ' LEU . 43.7 mt-30 -94.34 140.58 29.62 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.25 -0.432 . . . . 74.2 110.758 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . 0.46 ' HA ' ' CG1' ' A' ' 467' ' ' VAL . 41.9 tt0 -75.0 141.26 43.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.534 -0.757 . . . . 64.21 109.541 175.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . 0.441 ' HD3' ' SD ' ' A' ' 466' ' ' MET . 54.4 mtmt . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.13 -0.938 . . . . 74.22 109.512 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo . . . . . 0 N--CA 1.455 -0.754 0 CA-C-O 120.857 0.274 . . . . 73.23 111.424 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 454' ' ' VAL . . . . . 0.438 HG12 ' HB ' ' A' ' 477' ' ' VAL . 19.6 t -74.9 111.26 10.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.59 -0.522 . . . . 72.02 109.59 178.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 90.6 mt -97.6 164.06 12.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.924 -0.58 . . . . 73.22 110.901 -175.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' ILE . . . . . 0.473 HD13 HG12 ' A' ' 477' ' ' VAL . 48.4 mm -96.87 115.06 35.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.838 -0.619 . . . . 63.45 110.193 -178.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 33.7 m -85.69 -35.61 20.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.145 0.498 . . . . 65.41 110.823 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 458' ' ' ARG . . . . . 0.839 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 5.7 mmp_? -108.52 108.14 60.71 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.094 -0.503 . . . . 71.14 110.362 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_exo -70.78 155.63 62.21 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.405 2.07 . . . . 72.2 111.436 176.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.11 162.7 23.59 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.774 -0.454 . . . . 74.2 109.774 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -69.91 121.04 16.56 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.487 0.661 . . . . 61.4 111.444 -173.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -92.22 -11.65 34.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.993 -1.003 . . . . 73.51 111.711 -176.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -87.56 156.01 19.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.127 0.489 . . . . 71.34 110.925 -170.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.659 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 6.0 tt -88.55 136.61 32.9 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.363 -0.835 . . . . 74.15 109.679 -171.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' VAL . . . . . 0.49 ' N ' HD23 ' A' ' 464' ' ' LEU . 30.6 m -120.97 172.25 8.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.269 0.557 . . . . 70.24 111.655 -173.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' MET . . . . . 0.621 ' H ' ' NE2' ' A' ' 469' ' ' GLN . 66.5 mtt -116.62 163.52 15.98 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.795 -0.639 . . . . 64.31 109.964 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' VAL . . . . . 0.5 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 48.6 t -65.04 131.02 30.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.338 -0.392 . . . . 72.12 111.185 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.14 -14.32 58.43 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.818 -0.706 . . . . 74.51 114.602 171.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.621 ' NE2' ' H ' ' A' ' 466' ' ' MET . 9.6 pt20 -83.17 149.42 26.86 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.923 0.862 . . . . 64.14 110.637 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 44.8 ttt180 -73.6 116.1 13.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.524 -0.762 . . . . 71.21 110.567 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 95.0 t -120.86 123.38 70.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.792 -0.64 . . . . 71.43 109.859 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -133.92 140.79 47.02 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.185 0.517 . . . . 74.52 110.172 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.544 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 90.5 m-85 -105.99 124.8 50.15 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.854 -0.612 . . . . 71.52 110.786 -175.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -97.63 117.73 32.57 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.969 -1.123 . . . . 74.13 107.969 176.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' CYS . . . . . 0.839 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 6.4 p -140.23 119.04 12.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.184 0.516 . . . . 73.1 111.699 -175.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.599 ' HG2' ' CG ' ' A' ' 458' ' ' ARG . 10.1 pt-20 -131.05 148.81 52.79 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.005 -0.739 . . . . 73.24 109.005 175.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 482' ' ' ALA . 18.3 m -111.19 164.38 7.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 116.238 -0.437 . . . . 73.13 110.859 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 53.5 p -65.67 -25.89 67.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.032 -0.531 . . . . 71.11 112.403 -174.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -106.87 133.7 51.13 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.912 -0.315 . . . . 70.34 110.786 -174.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' GLU . . . . . 0.665 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 10.0 tp10 -73.36 147.4 44.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.086 -0.506 . . . . 74.43 110.673 -178.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 61.27 34.45 88.2 Favored Glycine 0 N--CA 1.453 -0.221 0 CA-C-N 115.898 -0.592 . . . . 53.52 112.82 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.49 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -95.19 154.45 17.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.006 0.432 . . . . 62.31 111.062 -178.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -100.77 133.11 45.72 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.75 -0.659 . . . . 73.02 110.647 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . 0.519 ' HB ' HD21 ' A' ' 527' ' ' LEU . 32.5 m -124.15 144.24 34.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.931 -0.577 . . . . 70.33 109.547 175.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -126.96 141.04 51.9 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.751 0.31 . . . . 65.14 110.292 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -98.3 137.35 37.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.086 -0.507 . . . . 73.44 111.074 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 55.6 tp -134.21 118.78 18.0 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.747 -0.835 . . . . 74.35 108.747 173.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' LYS . . . . . 0.455 ' HD3' ' C ' ' A' ' 488' ' ' LYS . 14.1 tmtt? -109.52 106.2 15.83 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.703 -0.399 . . . . 64.22 110.518 -176.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 2.5 t70 48.66 38.74 12.08 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.333 -0.849 . . . . 72.4 112.015 173.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.62 -16.01 60.26 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.79 -0.719 . . . . 73.01 113.001 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 47.4 t -104.72 122.23 57.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.741 0.305 . . . . 72.11 110.427 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -81.46 133.94 35.47 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.765 -0.457 . . . . 62.02 109.765 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 69.4 mt -74.99 152.89 38.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.104 -0.498 . . . . 65.33 111.114 -175.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' THR . . . . . 0.685 HG22 ' H ' ' A' ' 496' ' ' GLU . 4.8 m -91.2 141.51 28.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.029 -0.532 . . . . 63.31 110.937 -175.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -83.13 -6.2 59.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.23 0.538 . . . . 74.23 110.539 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' GLU . . . . . 0.685 ' H ' HG22 ' A' ' 494' ' ' THR . 7.6 pt-20 -130.35 34.72 4.15 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.554 -0.748 . . . . 73.2 109.763 178.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' GLU . . . . . 0.569 ' HB2' ' HB ' ' A' ' 494' ' ' THR . 7.1 tp10 -71.93 170.71 13.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.315 -0.857 . . . . 71.42 110.782 -176.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' THR . . . . . 0.473 HG23 ' H ' ' A' ' 500' ' ' LYS . 8.9 t -68.58 -176.7 0.83 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.119 -0.491 . . . . 74.22 110.837 175.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -78.99 17.1 0.79 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.456 -0.338 . . . . 71.12 111.853 -174.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' LYS . . . . . 0.473 ' H ' HG23 ' A' ' 498' ' ' THR . 21.6 tptm -61.87 -45.96 91.48 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.908 -0.775 . . . . 74.44 108.908 176.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' TYR . . . . . 0.558 ' HB3' HG12 ' A' ' 514' ' ' ILE . 10.1 p90 -143.04 143.39 31.86 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.054 -0.976 . . . . 73.24 109.52 176.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 35.9 p-90 -135.91 145.34 46.18 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.865 -0.42 . . . . 71.52 109.865 176.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 503' ' ' PHE . . . . . 0.478 ' HA ' ' O ' ' A' ' 511' ' ' HIS . 44.6 p90 -114.86 140.9 48.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.592 0.711 . . . . 64.13 111.818 -175.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 504' ' ' LYS . . . . . 0.463 ' HB3' ' HB2' ' A' ' 511' ' ' HIS . 24.1 tptm -116.31 114.18 23.99 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.802 -1.09 . . . . 74.31 109.137 176.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.482 ' O ' ' HD3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -112.37 138.37 49.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.06 0.457 . . . . 72.51 112.192 -176.169 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -149.59 85.41 1.44 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.836 -0.62 . . . . 62.15 109.855 170.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 69.5 -116.68 7.18 Favored Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 115.614 -0.721 . . . . 61.25 112.777 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 508' ' ' GLN . . . . . 0.665 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 4.1 pt20 -76.98 -25.95 53.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.708 0.29 . . . . 74.13 111.508 -177.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 509' ' ' ARG . 3.9 ptt180 -99.12 127.0 44.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.374 0.606 . . . . 71.14 111.448 -174.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -129.39 155.96 44.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.477 -0.783 . . . . 70.44 109.705 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 511' ' ' HIS . . . . . 0.478 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 80.4 m-70 -138.9 124.58 19.62 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.897 -0.408 . . . . 73.23 109.897 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 56.9 tp -111.46 106.09 14.89 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.929 -0.397 . . . . 62.42 109.929 176.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 513' ' ' ILE . . . . . 0.407 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.5 mp -103.25 118.41 50.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.06 0.457 . . . . 71.31 111.018 -176.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 514' ' ' ILE . . . . . 0.558 HG12 ' HB3' ' A' ' 501' ' ' TYR . 62.2 mt -101.9 121.76 53.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.145 -0.687 . . . . 74.25 109.145 174.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -64.14 -51.41 64.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.267 -0.424 . . . . 54.35 111.396 -174.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -133.01 114.87 14.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.342 -0.39 . . . . 73.2 110.151 175.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -62.69 127.53 31.7 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.695 -0.483 . . . . 75.12 109.695 173.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 28.6 ttm -132.58 173.68 11.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.976 -0.379 . . . . 74.31 109.976 -174.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.428 ' H ' HD22 ' A' ' 519' ' ' LEU . 3.4 mm? -53.43 -36.63 61.76 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.606 0.595 . . . . 74.01 112.606 -172.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 520' ' ' GLU . . . . . 0.486 ' CD ' ' H ' ' A' ' 520' ' ' GLU . 1.8 mp0 -58.92 -35.02 72.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.948 0.404 . . . . 74.14 110.895 -178.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -74.43 -13.52 60.72 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.995 -0.548 . . . . 73.43 112.223 -169.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 522' ' ' ALA . . . . . 0.588 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -63.78 7.33 0.12 Allowed 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.911 1.078 . . . . 72.33 113.911 -175.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -86.63 169.3 40.82 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.987 -0.625 . . . . 72.14 112.443 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -73.97 119.84 18.74 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 122.717 -0.284 . . . . 74.51 110.804 -178.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -86.43 135.0 33.66 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.765 0.317 . . . . 72.2 110.804 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.4 134.63 47.28 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.062 0.458 . . . . 44.53 110.475 175.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 527' ' ' LEU . . . . . 0.519 HD21 ' HB ' ' A' ' 484' ' ' VAL . 7.5 tt -118.04 111.85 19.46 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.053 -0.721 . . . . 71.43 109.053 177.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 43.9 t -99.24 128.1 45.32 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.926 0.393 . . . . 62.41 110.593 -177.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 529' ' ' THR . . . . . 0.529 HG22 ' H ' ' A' ' 530' ' ' SER . 1.8 m -117.88 175.47 5.65 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.892 -0.594 . . . . 75.33 109.45 176.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 530' ' ' SER . . . . . 0.529 ' H ' HG22 ' A' ' 529' ' ' THR . 9.1 m -58.52 -24.36 60.38 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.014 0.375 . . . . 42.12 112.014 178.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -112.28 -88.38 1.76 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.637 -0.792 . . . . 73.35 112.21 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -94.18 -172.25 38.58 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.819 -0.705 . . . . 43.22 112.016 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -145.49 147.55 32.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.005 0.431 . . . . 74.02 110.725 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 534' ' ' ALA . . . . . 0.433 ' HB2' HG21 ' A' ' 456' ' ' ILE . . . -105.75 118.71 37.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.007 -0.542 . . . . 75.33 110.115 178.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 7.5 tt -114.99 124.72 52.4 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.441 -0.577 . . . . 74.23 109.441 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -148.36 149.11 31.2 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.985 -0.552 . . . . 61.43 109.809 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -116.77 112.92 21.83 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.372 0.606 . . . . 72.23 111.052 -177.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.588 ' O ' ' HA ' ' A' ' 522' ' ' ALA . 31.3 tp -96.92 111.5 23.68 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.298 -0.864 . . . . 73.15 109.462 -179.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 539' ' ' ILE . . . . . 0.659 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 63.3 mt -97.47 129.11 48.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 110.129 -0.323 . . . . 63.34 110.129 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 34.7 t -111.54 116.47 52.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 61.42 110.601 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 541' ' ' GLN . . . . . 0.565 ' HG3' HD21 ' A' ' 464' ' ' LEU . 98.4 mt-30 -99.61 155.44 17.6 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.085 0.469 . . . . 75.34 111.173 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -80.56 149.75 29.82 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.615 -0.721 . . . . 74.22 110.654 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.723 -0.656 . . . . 73.42 110.157 -179.756 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.651 0 N-CA-C 111.501 -0.64 . . . . 62.41 111.501 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 2.7 p -74.87 137.21 41.62 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.861 0.363 . . . . 75.34 110.058 177.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 17.4 p-80 -89.45 59.44 4.8 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.373 0.606 . . . . 62.42 110.642 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 24.5 mmt -100.41 106.54 43.19 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.515 -0.766 . . . . 73.23 109.539 177.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -71.06 140.1 37.12 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.728 2.285 . . . . 43.44 111.537 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 48.2 t -66.34 115.83 4.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 109.623 -0.51 . . . . 72.43 109.623 176.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -78.59 143.57 36.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.172 -0.467 . . . . 34.12 110.884 -174.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.492 HG21 ' HB2' ' A' ' 534' ' ' ALA . 37.8 mm -95.49 110.77 24.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.356 -0.609 . . . . 63.3 109.356 175.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . 0.437 ' HB ' ' HG3' ' A' ' 476' ' ' GLU . 16.5 m -67.99 -40.91 82.97 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.019 0.438 . . . . 74.13 111.318 -175.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.716 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 19.5 mmt85 -116.67 120.39 34.43 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.152 -0.476 . . . . 62.12 110.472 -176.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -76.12 165.53 29.48 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 121.935 1.757 . . . . 62.32 110.45 170.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 3.7 mm? -80.43 149.03 30.29 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.647 -0.421 . . . . 65.14 109.98 179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 23.5 mp0 -52.62 119.38 4.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.267 -0.879 . . . . 63.44 111.999 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -92.01 -11.24 36.53 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.819 -1.082 . . . . 72.24 112.154 -176.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.6 pm0 -88.69 155.12 19.77 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.166 0.508 . . . . 62.4 111.139 -172.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 9.4 tt -87.81 136.14 33.08 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.624 -0.716 . . . . 73.44 109.751 -174.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 35.7 m -121.44 175.65 4.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.987 -0.552 . . . . 75.34 110.937 -176.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . 0.448 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 25.2 ptt? -120.85 152.25 38.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.199 -0.455 . . . . 72.33 111.077 -176.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 69.3 t -61.55 139.33 20.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.463 -0.79 . . . . 73.23 111.244 178.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.35 -18.34 54.01 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.76 -0.733 . . . . 61.23 114.105 173.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.448 ' HG2' ' O ' ' A' ' 466' ' ' MET . 9.7 pt20 -94.33 155.47 16.98 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 117.836 0.818 . . . . 75.12 110.953 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . 0.522 ' HG3' ' HA ' ' A' ' 515' ' ' ASN . 42.6 ttm180 -88.02 116.0 25.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.787 -0.642 . . . . 73.23 109.832 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.403 HG22 HE21 ' A' ' 469' ' ' GLN . 10.4 t -112.78 127.6 69.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.987 0.422 . . . . 65.52 110.877 -175.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -104.59 123.63 47.89 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.774 -0.648 . . . . 73.12 110.048 179.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.589 ' HE2' HD12 ' A' ' 514' ' ' ILE . 67.5 m-85 -107.39 134.34 50.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.209 -0.45 . . . . 72.43 109.941 -178.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -122.96 118.43 27.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.03 0.443 . . . . 73.02 111.37 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 23.0 t -143.08 113.56 7.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.743 -0.662 . . . . 74.32 109.539 176.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.688 ' HB2' ' HA ' ' A' ' 509' ' ' ARG . 13.0 pt-20 -133.51 166.42 22.61 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.291 -0.413 . . . . 75.15 110.841 -177.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.545 HG21 ' HB3' ' A' ' 482' ' ' ALA . 6.7 m -101.09 159.56 3.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.757 -0.656 . . . . 72.1 110.505 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 22.2 t -80.79 -2.28 46.46 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.151 -0.477 . . . . 73.34 111.227 -176.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -134.17 132.8 40.23 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.691 -0.485 . . . . 63.11 109.691 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -78.94 153.02 30.75 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.179 0.514 . . . . 73.44 112.007 -173.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 95.62 -16.85 60.42 Favored Glycine 0 N--CA 1.449 -0.49 0 CA-C-N 115.52 -0.763 . . . . 52.12 112.359 178.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.545 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -82.77 132.84 35.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.199 0.523 . . . . 72.43 111.521 -177.165 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -105.15 165.13 11.31 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.507 -0.769 . . . . 65.31 110.189 178.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.56 HG21 HD11 ' A' ' 527' ' ' LEU . 27.3 m -137.0 173.22 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.39 -0.368 . . . . 71.24 110.997 -174.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . 0.402 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 40.6 ttmt -117.44 140.32 49.74 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.08 -0.509 . . . . 60.13 109.649 174.145 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -98.71 124.05 43.3 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.152 0.501 . . . . 75.41 110.445 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . 0.406 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 53.2 tp -115.68 119.21 35.33 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.032 -0.729 . . . . 75.32 109.032 177.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.42 ' HE2' ' HA3' ' A' ' 523' ' ' GLY . 14.0 tmtt? -121.17 113.05 19.44 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.348 -0.387 . . . . 54.11 110.778 -175.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . 0.467 ' HB2' ' HA3' ' A' ' 523' ' ' GLY . 35.1 t0 55.22 37.92 29.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.483 -0.78 . . . . 70.41 111.43 173.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 85.03 -4.13 86.02 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.731 -0.747 . . . . 61.24 112.743 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 44.3 t -103.63 131.86 51.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 120.782 0.325 . . . . 71.33 110.387 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -83.29 113.96 21.06 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.669 -0.493 . . . . 74.24 109.669 177.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 92.9 mt -69.32 159.88 32.31 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.184 -0.462 . . . . 71.42 111.263 -176.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . 0.669 HG23 ' HG2' ' A' ' 496' ' ' GLU . 7.5 t -89.54 155.14 19.47 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.771 -0.649 . . . . 75.12 110.175 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.5 ttt-85 -79.25 77.04 5.78 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.724 0.297 . . . . 63.53 110.547 -177.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . 0.669 ' HG2' HG23 ' A' ' 494' ' ' THR . 8.4 pt-20 -176.46 147.25 0.66 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.891 -0.595 . . . . 64.23 109.749 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . 0.481 ' HB2' ' HA ' ' A' ' 502' ' ' TRP . 1.0 OUTLIER -104.52 171.32 7.4 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.966 0.412 . . . . 72.02 110.398 177.386 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.459 HG23 ' H ' ' A' ' 500' ' ' LYS . 7.8 t -149.04 -178.16 6.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.457 -0.572 . . . . 71.21 109.457 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -77.88 -3.84 43.71 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.793 0.33 . . . . 73.42 111.346 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . 0.459 ' H ' HG23 ' A' ' 498' ' ' THR . 64.2 tttp -82.8 -48.62 10.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.352 0.596 . . . . 64.1 109.535 174.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.615 ' HD2' HD11 ' A' ' 512' ' ' LEU . 19.7 p90 -151.71 141.66 22.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.364 -0.835 . . . . 75.21 109.371 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' TRP . . . . . 0.529 ' HZ3' ' HB2' ' A' ' 504' ' ' LYS . 55.0 p-90 -140.84 150.51 43.37 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.863 0.363 . . . . 72.52 110.602 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . 0.596 ' HA ' ' O ' ' A' ' 511' ' ' HIS . 41.1 p90 -124.76 139.67 53.64 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.14 -0.482 . . . . 70.23 110.147 178.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.529 ' HB2' ' HZ3' ' A' ' 502' ' ' TRP . 61.2 tttm -116.44 145.24 43.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.02 0.438 . . . . 63.51 110.688 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -107.0 141.78 37.66 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.52 -0.764 . . . . 72.25 109.911 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . 0.519 ' HB3' ' CG ' ' A' ' 509' ' ' ARG . 38.6 t70 -149.94 87.14 1.46 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.863 -0.421 . . . . 63.33 109.863 170.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 68.45 -87.96 0.2 Allowed Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.769 -0.65 . . . . 73.04 112.675 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -107.52 -27.23 10.52 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.09 0.471 . . . . 74.21 110.924 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.688 ' HA ' ' HB2' ' A' ' 476' ' ' GLU . 6.7 ptp180 -87.99 143.2 27.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.356 0.598 . . . . 72.51 111.684 -170.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -135.12 126.9 29.24 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.354 -0.839 . . . . 73.43 109.108 179.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . 0.596 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 25.8 m-70 -121.2 126.79 50.53 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.949 -0.389 . . . . 74.43 109.949 -177.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.615 HD11 ' HD2' ' A' ' 501' ' ' TYR . 62.8 tp -110.66 108.06 17.84 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.806 -0.442 . . . . 63.43 109.806 178.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.413 HD12 ' N ' ' A' ' 513' ' ' ILE . 3.7 mp -105.14 123.83 59.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 120.852 0.358 . . . . 74.41 110.648 -176.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.589 HD12 ' HE2' ' A' ' 473' ' ' PHE . 45.1 mt -105.53 122.15 58.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.919 -0.582 . . . . 64.31 109.522 175.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . 0.522 ' HA ' ' HG3' ' A' ' 470' ' ' ARG . 43.1 m-80 -66.13 -42.01 89.73 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.922 -0.581 . . . . 74.11 111.976 -172.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -140.94 116.02 9.86 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.352 -0.24 . . . . 74.54 110.352 176.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.417 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -62.6 123.46 18.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.924 -0.398 . . . . 63.12 109.924 175.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 45.0 tpp -132.65 171.94 13.19 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.697 -0.483 . . . . 75.42 109.697 -177.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -56.46 -32.28 64.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.571 0.224 . . . . 73.54 111.004 177.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -59.25 -37.25 77.11 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.402 0.62 . . . . 72.25 110.525 176.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -86.73 -13.22 45.96 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.119 -0.946 . . . . 44.14 110.894 -173.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.464 ' HB2' ' HB ' ' A' ' 540' ' ' VAL . . . -66.91 7.62 0.36 Allowed 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.222 0.823 . . . . 53.24 113.222 -176.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . 0.467 ' HA3' ' HB2' ' A' ' 489' ' ' ASP . . . -79.23 165.96 50.99 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.701 -0.761 . . . . 73.04 112.309 178.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 57.1 m170 -71.07 151.39 44.57 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 122.76 -0.259 . . . . 71.04 110.625 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -124.83 124.86 42.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.19 0.519 . . . . 75.21 111.496 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.406 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -128.77 135.44 49.18 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.919 -0.582 . . . . 42.5 110.348 177.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.613 HD13 ' SG ' ' A' ' 475' ' ' CYS . 2.1 tt -107.95 107.83 18.71 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.999 -0.546 . . . . 73.12 109.909 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 70.2 m -88.8 114.85 25.86 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.073 -0.512 . . . . 74.51 111.676 -174.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.545 ' HB ' ' O ' ' A' ' 532' ' ' GLY . 9.3 m -119.19 158.16 26.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.681 -0.691 . . . . 73.25 109.669 173.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 12.5 m -68.26 -26.65 65.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.804 0.335 . . . . 74.22 111.387 179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -87.89 -90.76 1.07 Allowed Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.824 -0.703 . . . . 70.32 111.637 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . 0.545 ' O ' ' HB ' ' A' ' 529' ' ' THR . . . -97.34 176.05 31.15 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.639 -0.791 . . . . 63.14 111.272 174.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -141.07 126.95 19.23 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.874 -0.417 . . . . 64.2 109.874 177.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . 0.492 ' HB2' HG21 ' A' ' 456' ' ' ILE . . . -96.93 117.75 31.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.387 -0.369 . . . . 73.42 110.112 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.418 HD23 ' N ' ' A' ' 536' ' ' ALA . 5.4 tt -120.79 127.82 52.31 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.331 -0.618 . . . . 63.04 109.331 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.555 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -148.55 153.88 39.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.267 -0.424 . . . . 73.55 110.157 178.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -119.18 118.86 32.46 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 121.373 0.606 . . . . 70.13 110.775 -176.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 44.3 tp -96.86 136.71 37.03 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.942 -1.026 . . . . 75.34 110.125 -177.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.422 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 65.6 mt -116.77 113.36 42.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.148 -0.478 . . . . 73.1 109.783 175.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.464 ' HB ' ' HB2' ' A' ' 522' ' ' ALA . 44.1 t -101.74 105.48 18.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.886 -0.597 . . . . 73.32 109.695 178.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -88.49 151.15 22.73 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.241 0.543 . . . . 72.13 111.267 -177.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -76.82 162.76 27.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.261 -0.881 . . . . 73.04 112.214 -169.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . 0.401 ' HB3' ' NZ ' ' A' ' 543' ' ' LYS . 8.2 mtpm? . . . . . 0 C--O 1.251 1.159 0 CA-C-N 115.087 -0.96 . . . . 63.21 109.174 173.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.756 0 N-CA-C 111.918 -0.473 . . . . 73.41 111.918 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 43.2 t -113.93 -44.21 3.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.096 0.475 . . . . 71.42 110.284 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -140.84 157.76 44.92 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.077 -0.511 . . . . 72.41 110.12 -178.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 21.9 ptt? -86.02 157.93 56.42 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.298 -0.41 . . . . 72.21 110.119 179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -64.79 151.67 84.88 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.162 1.908 . . . . 73.14 111.447 175.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.45 HG21 ' HB3' ' A' ' 530' ' ' SER . 48.3 t -67.12 110.21 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.809 0.338 . . . . 65.24 110.597 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 86.6 mt -78.83 130.47 35.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.968 -0.56 . . . . 73.55 110.524 -179.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 45.7 mm -91.28 110.44 22.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.866 -0.606 . . . . 64.33 110.057 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 26.3 m -79.95 -28.87 39.61 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.29 -0.414 . . . . 75.05 111.346 -176.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.535 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 36.3 mmt-85 -126.35 119.02 23.26 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.61 -0.268 . . . . 63.3 111.077 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 458' ' ' ARG . 3.0 Cg_exo -76.06 167.27 26.36 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 123.062 2.508 . . . . 55.11 111.548 174.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 91.2 mt -81.94 169.58 16.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.646 0.26 . . . . 75.41 110.609 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -69.57 120.05 14.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.029 -0.532 . . . . 63.1 111.426 -175.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -93.61 -14.36 26.58 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.861 -0.608 . . . . 65.13 111.32 178.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.9 pm0 -90.73 157.42 17.43 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.335 0.588 . . . . 75.35 111.623 -173.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.483 HD11 HE21 ' A' ' 541' ' ' GLN . 10.5 tt -87.48 142.15 28.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.185 -0.916 . . . . 72.14 110.713 -170.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.487 HG23 HG22 ' A' ' 540' ' ' VAL . 28.9 m -126.75 174.0 11.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.996 -0.547 . . . . 64.11 110.269 -179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . 0.509 ' HG2' ' HG3' ' A' ' 541' ' ' GLN . 46.7 mtm -133.13 162.24 32.26 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.418 -0.355 . . . . 74.45 110.882 -178.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . 0.541 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 49.8 t -64.63 137.36 25.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 115.911 -0.586 . . . . 61.14 111.618 -176.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 100.93 -0.68 55.09 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.764 -0.731 . . . . 71.4 114.039 173.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -120.08 159.0 25.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.42 0.61 . . . . 63.24 110.715 -179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 514' ' ' ILE . 37.6 ttm105 -87.38 138.59 31.35 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 63.14 111.176 -175.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 47.1 t -115.96 133.34 62.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.92 -0.582 . . . . 62.32 110.454 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -109.21 122.81 48.12 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.203 -0.453 . . . . 71.14 110.036 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.653 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 64.9 m-85 -108.31 112.29 24.68 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.385 -0.371 . . . . 64.03 110.418 176.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.513 ' HG2' ' CE1' ' A' ' 511' ' ' HIS . 33.7 mt-10 -98.71 120.11 38.59 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.284 -0.636 . . . . 64.2 109.284 174.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.535 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 13.9 t -144.84 109.16 4.84 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.089 -0.708 . . . . 73.34 109.089 171.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.514 ' OE1' ' HB2' ' A' ' 509' ' ' ARG . 0.4 OUTLIER -113.93 134.63 54.7 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 108.699 -0.852 . . . . 74.11 108.699 -176.277 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.532 HG21 ' HB3' ' A' ' 482' ' ' ALA . 30.0 m -95.61 145.23 8.68 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.567 -0.531 . . . . 60.44 109.567 176.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 32.3 t -72.64 -11.73 60.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.328 -0.396 . . . . 61.31 111.721 -175.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -133.12 137.62 46.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.846 0.355 . . . . 65.04 111.886 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -71.01 149.3 46.77 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.855 -0.611 . . . . 75.31 109.663 174.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 84.42 15.43 68.83 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.663 -0.78 . . . . 72.55 112.34 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.532 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -91.73 110.47 21.81 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.799 0.333 . . . . 72.05 110.733 177.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -67.53 143.89 55.91 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.948 -0.569 . . . . 63.14 110.515 177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 22.3 m -128.62 143.41 41.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.215 -0.448 . . . . 73.54 110.497 179.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . 0.48 ' HB3' ' HB3' ' A' ' 528' ' ' CYS . 25.1 ttmm -129.09 129.25 44.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.056 -0.52 . . . . 65.12 110.155 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -98.46 119.77 37.74 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.124 0.488 . . . . 75.51 110.762 179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 7.8 tt -116.99 119.74 36.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.734 -0.666 . . . . 74.23 109.331 178.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -105.05 105.73 15.9 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.418 -0.356 . . . . 74.31 110.815 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . 0.454 ' HB2' ' HA3' ' A' ' 523' ' ' GLY . 4.0 t70 46.88 46.33 15.44 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.257 -0.883 . . . . 65.33 111.33 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.36 -27.25 20.29 Favored Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.743 -0.662 . . . . 72.11 113.22 177.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 47.5 t -101.5 119.22 49.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 117.12 0.46 . . . . 63.44 110.775 -176.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -65.32 128.73 37.06 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.725 -0.472 . . . . 71.04 109.725 176.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 4.4 pp -91.52 163.13 14.26 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.758 0.313 . . . . 71.44 110.301 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 2.4 p -100.05 142.66 31.23 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.086 0.47 . . . . 72.11 111.583 -176.292 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.41 2.29 9.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.652 -0.703 . . . . 73.23 111.427 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -126.77 34.68 4.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.156 -0.475 . . . . 62.03 110.767 -176.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -82.98 -179.94 7.59 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.892 -0.594 . . . . 61.31 111.396 179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 13.7 t -65.11 165.71 10.77 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.824 -0.626 . . . . 72.24 111.635 -176.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 20.3 p90 -74.93 14.26 0.54 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.626 -0.715 . . . . 63.44 112.603 -173.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -59.15 -44.93 92.11 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.214 0.53 . . . . 72.42 110.218 177.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.428 ' CB ' HG12 ' A' ' 514' ' ' ILE . 1.5 p90 -144.62 125.04 13.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.516 -0.766 . . . . 74.1 109.681 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 11.9 p-90 -123.26 160.24 27.04 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.831 -0.622 . . . . 70.34 110.162 -174.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 52.3 p90 -124.02 151.08 44.16 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.14 0.495 . . . . 65.1 111.357 -175.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -117.16 138.27 51.78 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.524 -0.762 . . . . 52.25 109.939 175.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.57 ' NZ ' ' HB3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -113.77 105.1 12.88 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.66 -0.867 . . . . 75.04 108.66 175.806 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . 0.638 ' HB2' ' HG2' ' A' ' 509' ' ' ARG . 32.4 m-20 -115.39 88.36 2.86 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.565 -0.531 . . . . 72.21 109.565 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 64.15 -94.8 0.16 Allowed Glycine 0 N--CA 1.448 -0.549 0 CA-C-N 115.873 -0.603 . . . . 52.33 112.584 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.501 ' O ' HG22 ' A' ' 477' ' ' VAL . 20.2 pt20 -103.31 -20.69 14.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.898 0.38 . . . . 75.15 111.108 -177.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.638 ' HG2' ' HB2' ' A' ' 506' ' ' ASP . 28.6 ptt180 -92.28 148.87 21.8 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.441 -0.504 . . . . 74.53 111.075 -172.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -134.47 117.13 15.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.783 -0.644 . . . . 71.13 109.906 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . 0.513 ' CE1' ' HG2' ' A' ' 474' ' ' GLU . 23.1 m-70 -121.22 126.79 50.49 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.806 -0.358 . . . . 71.14 111.098 -177.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.4 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 58.3 tp -107.33 117.36 33.86 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.107 -0.701 . . . . 72.51 109.107 176.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 68.6 mt -111.51 108.33 25.21 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 120.961 0.41 . . . . 71.45 110.871 -175.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.504 ' O ' ' HG3' ' A' ' 470' ' ' ARG . 35.8 mt -86.86 120.55 36.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 108.543 -0.91 . . . . 75.23 108.543 173.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -68.61 -45.88 70.77 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.899 -0.32 . . . . 54.41 110.715 -176.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -140.61 109.12 5.89 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.641 -0.503 . . . . 72.24 109.641 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.541 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -64.62 136.43 56.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.954 -0.566 . . . . 72.12 111.013 -179.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 72.1 mtm -134.16 174.91 9.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.96 -0.563 . . . . 75.43 110.521 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.463 ' H ' HD22 ' A' ' 519' ' ' LEU . 3.1 mm? -53.53 -33.0 52.96 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.769 0.655 . . . . 64.23 112.769 -171.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -59.71 -29.7 68.3 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.412 0.625 . . . . 74.25 111.297 -179.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . 0.482 ' HB2' HG21 ' A' ' 540' ' ' VAL . 30.3 m-20 -82.14 -11.86 58.5 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.326 -0.852 . . . . 74.3 111.462 -170.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.497 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -67.22 6.61 0.53 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.394 0.516 . . . . 74.21 112.394 178.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . 0.454 ' HA3' ' HB2' ' A' ' 489' ' ' ASP . . . -80.99 167.99 50.37 Favored Glycine 0 N--CA 1.446 -0.697 0 C-N-CA 121.051 -0.595 . . . . 54.34 112.359 178.28 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . 0.423 ' CD2' ' HB3' ' A' ' 537' ' ' GLU . 62.8 m80 -79.86 106.58 11.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.688 0.28 . . . . 73.43 110.935 -178.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -76.57 124.36 27.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.383 0.611 . . . . 74.44 111.035 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -123.75 135.95 54.14 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.464 -0.789 . . . . 50.15 109.585 175.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.623 ' HB3' ' HB3' ' A' ' 534' ' ' ALA . 6.2 tt -117.2 108.64 15.91 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.425 -0.583 . . . . 71.23 109.425 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . 0.48 ' HB3' ' HB3' ' A' ' 485' ' ' LYS . 42.3 t -86.76 115.29 24.1 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 109.051 -0.722 . . . . 65.13 109.051 176.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.436 HG22 ' H ' ' A' ' 530' ' ' SER . 0.2 OUTLIER -95.3 175.18 6.69 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.501 -0.318 . . . . 64.15 110.417 -176.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . 0.45 ' HB3' HG21 ' A' ' 454' ' ' VAL . 22.9 t -65.3 -5.99 8.69 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.922 0.391 . . . . 71.1 111.313 177.064 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -149.5 -54.81 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.711 -0.757 . . . . 60.31 112.469 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -95.47 -171.49 36.31 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.803 -0.713 . . . . 41.43 112.837 -177.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -140.98 136.93 32.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.876 0.37 . . . . 70.24 110.407 178.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . 0.623 ' HB3' ' HB3' ' A' ' 527' ' ' LEU . . . -115.98 143.52 45.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.119 -0.491 . . . . 61.51 109.954 176.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 64.3 tp -147.29 126.19 12.75 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.62 -0.264 . . . . 75.21 110.445 -178.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -150.1 152.01 34.09 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.259 -0.428 . . . . 53.54 110.208 177.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . 0.423 ' HB3' ' CD2' ' A' ' 524' ' ' HIS . 10.4 pt-20 -108.38 113.98 27.48 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.148 0.499 . . . . 73.11 110.41 178.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.653 HD22 ' HZ ' ' A' ' 473' ' ' PHE . 39.4 tp -96.3 111.43 23.5 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.928 -0.767 . . . . 62.33 108.928 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 48.4 mt -93.06 112.74 26.76 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 116.409 -0.36 . . . . 63.24 110.342 -177.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.487 HG22 HG23 ' A' ' 465' ' ' VAL . 24.6 t -109.4 113.14 43.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.831 -0.622 . . . . 71.14 109.787 177.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . 0.509 ' HG3' ' HG2' ' A' ' 466' ' ' MET . 8.0 pt20 -115.18 157.24 23.93 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.023 0.439 . . . . 72.02 110.978 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -78.69 135.23 37.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.541 -0.754 . . . . 74.23 110.282 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . 0.444 ' HE2' ' O ' ' A' ' 467' ' ' VAL . 59.0 pttt . . . . . 0 C--O 1.248 0.98 0 CA-C-O 118.735 -0.65 . . . . 72.13 109.901 178.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.769 0 N-CA-C 111.861 -0.496 . . . . 75.25 111.861 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 6.9 p -67.17 -52.83 36.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.959 0.409 . . . . 70.23 111.242 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 66.0 m80 -78.73 104.64 9.48 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.01 -0.541 . . . . 74.23 110.213 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . 0.421 ' HA ' ' HD3' ' A' ' 453' ' ' PRO . 44.4 ttm -123.91 119.75 26.68 Favored Pre-proline 0 C--N 1.318 -0.804 0 CA-C-N 115.852 -0.613 . . . . 72.52 110.544 -175.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 452' ' ' MET . 6.0 Cg_exo -78.41 158.67 29.3 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.728 2.286 . . . . 74.25 111.405 176.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 56.9 t -66.92 112.48 2.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 109.926 -0.398 . . . . 60.21 109.926 176.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 89.6 mt -90.06 144.09 26.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.521 . . . . 65.4 111.458 -175.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.493 HD13 HG12 ' A' ' 477' ' ' VAL . 42.9 mm -104.73 113.6 42.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.649 -0.705 . . . . 75.55 109.876 178.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . 0.413 ' OG1' ' HG3' ' A' ' 476' ' ' GLU . 2.9 p -93.8 -4.84 49.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.843 0.354 . . . . 63.44 111.873 -177.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.618 ' HB2' ' HG2' ' A' ' 476' ' ' GLU . 0.0 OUTLIER -135.02 99.68 12.25 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.562 -0.29 . . . . 74.44 110.544 177.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -71.64 167.15 27.27 Favored 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.651 2.234 . . . . 72.3 111.973 174.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.588 ' HB2' ' HB3' ' A' ' 536' ' ' ALA . 79.0 mt -83.66 171.05 13.64 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.275 -0.42 . . . . 72.03 111.407 -175.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . 0.441 ' HB2' ' HE1' ' A' ' 473' ' ' PHE . 7.8 mm-40 -67.7 118.38 10.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.921 -0.581 . . . . 63.21 111.089 -179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -95.37 -11.24 28.06 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.908 -0.587 . . . . 74.32 111.838 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -88.65 157.5 18.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.293 0.568 . . . . 73.43 111.794 -170.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 8.8 tt -87.24 131.88 34.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.394 -0.821 . . . . 74.21 110.228 -172.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 33.1 m -124.92 176.24 6.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.871 -0.604 . . . . 71.21 110.659 -177.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 25.6 ptt? -113.69 157.51 22.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.046 0.451 . . . . 60.43 110.926 -179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 73.3 t -66.49 138.67 22.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.549 -0.751 . . . . 74.34 111.272 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.01 -2.06 55.25 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.913 -0.661 . . . . 71.25 114.004 174.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -110.28 163.08 13.99 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 117.671 0.736 . . . . 75.25 111.068 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -82.28 131.03 35.23 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.725 -0.671 . . . . 72.34 110.863 178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 60.7 t -131.61 122.0 49.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.243 -0.435 . . . . 74.2 110.169 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.62 ' HG2' HG12 ' A' ' 513' ' ' ILE . 21.8 mt-10 -101.68 138.58 38.47 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.079 0.466 . . . . 64.34 111.222 176.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.647 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 35.3 m-85 -105.69 112.98 26.27 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.943 -0.762 . . . . 71.23 108.943 171.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.421 ' HB2' ' HE ' ' A' ' 458' ' ' ARG . 42.8 mt-10 -98.29 117.63 33.12 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.467 -0.568 . . . . 63.01 109.467 179.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.504 ' HA ' ' HB3' ' A' ' 458' ' ' ARG . 22.5 t -132.72 125.28 29.87 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.793 -0.447 . . . . 74.44 109.793 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.618 ' HG2' ' HB2' ' A' ' 458' ' ' ARG . 11.3 pt-20 -133.08 153.76 51.21 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.958 -0.564 . . . . 73.22 109.996 178.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.559 HG21 ' HB3' ' A' ' 482' ' ' ALA . 8.1 m -117.37 155.49 19.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 CA-C-N 115.465 -0.789 . . . . 64.43 109.906 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 6.5 p -81.16 -2.44 48.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.056 0.455 . . . . 75.23 111.638 -177.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -124.4 130.47 52.54 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.604 -0.887 . . . . 71.44 108.604 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -89.13 132.76 34.67 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.226 0.536 . . . . 45.32 111.605 -174.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 102.73 6.42 46.58 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.81 -0.71 . . . . 24.12 111.975 -178.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.559 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -82.13 127.53 33.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.694 0.283 . . . . 55.3 110.481 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -80.09 142.85 34.47 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.117 -0.492 . . . . 73.33 110.671 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.54 HG12 HG22 ' A' ' 529' ' ' THR . 35.7 m -124.04 148.77 28.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.965 -0.561 . . . . 71.31 110.579 -177.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . 0.41 ' HA ' ' HE3' ' A' ' 485' ' ' LYS . 1.3 tpmt? -127.29 134.84 49.98 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.25 -0.432 . . . . 74.23 110.238 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -97.85 120.83 38.94 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.941 -0.392 . . . . 74.42 109.941 177.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 51.0 tp -116.82 120.61 39.05 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.651 -0.5 . . . . 55.25 109.651 177.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.442 ' HD3' ' C ' ' A' ' 488' ' ' LYS . 14.2 tmtt? -109.3 106.89 16.9 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.862 0.363 . . . . 74.34 110.599 -176.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.6 t70 51.02 37.86 18.95 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.534 -0.757 . . . . 65.13 111.871 174.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 91.92 -14.04 65.33 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.769 -0.729 . . . . 52.53 112.641 179.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 40.0 t -94.33 130.0 43.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 120.783 0.325 . . . . 73.12 110.171 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -89.96 114.66 26.52 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.546 -0.909 . . . . 74.52 108.546 178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.519 ' O ' HD12 ' A' ' 493' ' ' LEU . 2.2 pp -74.0 134.35 43.05 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.703 0.763 . . . . 75.43 112.125 -172.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.93 174.53 11.52 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.079 -0.964 . . . . 64.53 111.265 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . 0.462 ' N ' ' HD3' ' A' ' 495' ' ' ARG . 0.0 OUTLIER -115.81 22.58 12.95 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 111.865 0.32 . . . . 73.34 111.865 -167.81 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 19.9 pm0 -126.74 20.25 7.15 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.661 0.245 . . . . 74.33 111.661 -177.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -82.87 159.94 22.26 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.579 0.228 . . . . 75.34 110.627 -178.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.442 HG23 ' H ' ' A' ' 500' ' ' LYS . 14.2 t -75.83 -179.67 4.95 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.149 0.499 . . . . 71.15 111.463 -176.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -81.28 19.64 0.93 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.672 0.619 . . . . 55.53 112.672 -172.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . 0.523 ' O ' ' HB3' ' A' ' 515' ' ' ASN . 58.7 tttp -63.17 -21.52 66.26 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 108.832 -0.803 . . . . 72.11 108.832 173.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.503 ' HB2' ' HA ' ' A' ' 514' ' ' ILE . 21.1 p90 -155.16 147.42 23.83 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 108.015 -1.105 . . . . 71.51 108.015 167.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 8.5 p-90 -154.09 159.12 41.36 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.212 -0.292 . . . . 74.24 110.212 -175.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -111.31 161.24 16.25 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.699 -0.4 . . . . 74.12 111.309 -177.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.978 ' HG2' ' HB2' ' A' ' 511' ' ' HIS . 14.4 ptpt -129.73 149.54 51.43 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 109.028 -0.73 . . . . 70.44 109.028 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.45 121.37 44.09 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.853 0.359 . . . . 73.22 110.509 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -115.97 80.96 1.52 Allowed 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.568 -0.53 . . . . 62.31 109.568 175.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.65 -110.33 3.39 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.796 -0.716 . . . . 52.14 112.293 -178.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -95.28 -5.54 43.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.347 0.594 . . . . 74.33 110.191 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.57 ' HG2' ' CB ' ' A' ' 476' ' ' GLU . 68.4 mtt85 -100.17 134.15 43.53 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.592 -0.731 . . . . 74.32 110.546 -175.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -116.51 134.38 54.92 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.825 0.345 . . . . 73.53 110.511 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . 0.978 ' HB2' ' HG2' ' A' ' 504' ' ' LYS . 11.5 m170 -117.91 123.2 45.25 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.111 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.467 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 46.7 tp -98.26 105.6 17.77 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.452 -0.573 . . . . 61.12 109.452 172.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.726 HD11 ' HE2' ' A' ' 504' ' ' LYS . 16.4 mt -93.67 107.6 19.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.937 -0.574 . . . . 73.52 110.451 -176.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.503 ' HA ' ' HB2' ' A' ' 501' ' ' TYR . 45.4 mt -78.13 114.89 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 106.615 -1.624 . . . . 73.25 106.615 168.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . 0.523 ' HB3' ' O ' ' A' ' 500' ' ' LYS . 9.3 t30 -72.51 -42.04 65.24 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.356 0.598 . . . . 65.12 109.838 -176.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -130.95 104.1 6.93 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.294 -0.866 . . . . 65.31 109.919 174.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -55.64 133.87 50.83 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.218 -0.66 . . . . 63.22 109.218 173.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . 0.524 ' H ' ' HB3' ' A' ' 521' ' ' ASP . 6.9 tpt -134.18 171.53 14.11 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.814 0.34 . . . . 63.0 111.389 -169.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.778 HD11 ' HB2' ' A' ' 542' ' ' GLU . 3.8 mm? -64.75 -49.27 71.43 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.306 -0.406 . . . . 75.04 111.699 -178.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -67.77 -22.41 65.2 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.141 0.496 . . . . 63.11 109.88 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . 0.524 ' HB3' ' H ' ' A' ' 518' ' ' MET . 16.6 t70 -74.74 -16.5 60.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.246 -0.888 . . . . 73.42 111.115 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.448 ' HB2' ' HB ' ' A' ' 540' ' ' VAL . . . -67.96 7.94 0.47 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 112.788 0.662 . . . . 44.55 112.788 -178.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -73.77 169.42 53.57 Favored Glycine 0 CA--C 1.521 0.449 0 C-N-CA 121.079 -0.581 . . . . 55.21 112.111 178.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 65.1 m170 -72.49 147.07 46.39 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 122.487 -0.42 . . . . 72.53 110.16 -179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -119.78 135.53 54.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.143 0.497 . . . . 74.22 111.431 -179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.45 ' HB2' ' HG ' ' A' ' 535' ' ' LEU . . . -144.06 135.46 25.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.839 -0.619 . . . . 34.34 110.637 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 10.5 tt -113.25 129.37 56.54 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.111 -0.7 . . . . 73.2 109.111 175.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 28.1 t -117.71 137.15 52.88 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.835 0.35 . . . . 74.1 110.27 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.54 HG22 HG12 ' A' ' 484' ' ' VAL . 67.5 p -109.55 -174.2 2.44 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.026 -0.534 . . . . 74.32 109.885 178.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 3.6 m -66.6 -11.17 52.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.167 -0.47 . . . . 65.41 110.651 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -115.8 -90.47 1.64 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 121.149 -0.548 . . . . 52.13 112.293 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -104.32 -173.06 25.08 Favored Glycine 0 C--O 1.236 0.221 0 C-N-CA 120.675 -0.774 . . . . 52.3 112.613 -178.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -133.83 156.74 47.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.895 0.379 . . . . 74.02 110.802 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -125.62 117.79 24.28 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.847 -0.615 . . . . 72.13 109.867 175.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.45 ' HG ' ' HB2' ' A' ' 526' ' ' ALA . 7.2 tt -118.37 132.85 56.25 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.347 -0.388 . . . . 75.22 110.414 -176.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.588 ' HB3' ' HB2' ' A' ' 460' ' ' LEU . . . -148.79 142.06 25.11 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.831 -0.622 . . . . 75.51 109.652 176.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -97.74 119.44 36.33 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.405 0.621 . . . . 71.0 111.042 -177.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.647 HD22 ' HZ ' ' A' ' 473' ' ' PHE . 43.8 tp -96.49 112.51 24.23 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.668 -0.697 . . . . 75.43 109.319 177.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 52.9 mt -93.64 112.16 26.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 109.694 -0.484 . . . . 63.11 109.694 178.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.448 ' HB ' ' HB2' ' A' ' 522' ' ' ALA . 23.4 t -106.16 110.97 33.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.111 -0.495 . . . . 73.1 110.138 -179.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -94.11 138.4 32.21 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.09 -0.505 . . . . 74.51 110.789 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . 0.779 ' HG2' ' HD3' ' A' ' 543' ' ' LYS . 21.3 tt0 -79.18 159.46 27.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.3 -0.409 . . . . 71.23 109.919 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . 0.779 ' HD3' ' HG2' ' A' ' 542' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.473 -0.775 . . . . 51.51 110.498 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.652 0 N-CA-C 111.872 -0.491 . . . . 64.04 111.872 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 4.9 m -69.99 -59.7 2.75 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.462 0.172 . . . . 74.21 111.433 -176.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 72.9 m-70 61.16 29.04 18.6 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.486 0.66 . . . . 61.2 110.366 -174.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . 0.402 ' HB3' ' HD2' ' A' ' 453' ' ' PRO . 66.2 mtt -109.57 167.28 9.34 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.423 -0.808 . . . . 71.34 109.657 -178.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 452' ' ' MET . 53.7 Cg_exo -53.92 155.07 15.44 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.297 1.998 . . . . 71.21 111.737 174.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.435 ' CG1' ' HB ' ' A' ' 477' ' ' VAL . 30.6 t -65.94 123.75 19.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.419 -0.355 . . . . 54.41 110.275 -177.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 6.6 mp -78.55 140.22 38.54 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.953 -0.567 . . . . 50.13 110.859 -177.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.588 HG13 ' HB2' ' A' ' 534' ' ' ALA . 33.7 mm -91.86 112.04 25.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.577 -0.738 . . . . 62.12 109.432 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . 0.421 ' OG1' ' HG3' ' A' ' 476' ' ' GLU . 0.4 OUTLIER -85.29 -25.62 27.1 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.095 0.405 . . . . 64.43 112.095 -177.041 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.502 ' HB2' ' HG2' ' A' ' 476' ' ' GLU . 6.4 mmm180 -130.61 111.66 16.32 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 110.096 -0.335 . . . . 72.45 110.096 177.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -76.15 168.5 23.9 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.966 2.444 . . . . 75.13 112.019 178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.499 HD21 ' HB2' ' A' ' 527' ' ' LEU . 3.5 mm? -80.22 160.08 25.72 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.924 -0.398 . . . . 51.03 109.924 -178.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . 0.591 ' HG2' ' HD1' ' A' ' 473' ' ' PHE . 27.1 mm-40 -58.55 119.02 6.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.904 -0.589 . . . . 73.03 111.071 -176.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -93.15 -10.94 34.08 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.675 -0.693 . . . . 72.14 111.616 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . 0.575 ' NE2' ' HB3' ' A' ' 461' ' ' GLU . 6.0 pm0 -88.53 156.51 19.04 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.117 0.484 . . . . 73.12 111.254 -174.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 10.5 tt -87.07 138.39 31.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.661 -0.7 . . . . 61.2 110.981 -168.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.559 HG22 HD11 ' A' ' 538' ' ' LEU . 29.7 m -125.98 177.6 5.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.74 -0.664 . . . . 72.12 110.809 -179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . 0.49 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 38.1 mtm -133.62 156.1 48.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.758 0.314 . . . . 74.31 111.202 -175.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . 0.491 ' CG2' ' HA ' ' A' ' 542' ' ' GLU . 55.8 t -64.53 144.47 14.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.684 -0.689 . . . . 71.2 111.768 -178.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 102.26 -25.25 28.37 Favored Glycine 0 C--N 1.332 0.307 0 CA-C-N 115.948 -0.569 . . . . 70.45 113.627 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 466' ' ' MET . 13.2 pt20 -98.23 168.35 10.29 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 117.237 0.519 . . . . 62.3 110.365 179.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 24.9 ttm180 -84.93 136.66 33.53 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.913 -0.403 . . . . 73.03 109.913 178.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 23.4 t -122.09 122.12 65.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.619 -0.511 . . . . 70.52 109.619 177.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.55 ' HG2' HG23 ' A' ' 513' ' ' ILE . 49.5 mt-10 -116.54 128.47 55.46 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.74 0.305 . . . . 72.2 110.56 -178.3 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.714 ' HD2' HD23 ' A' ' 512' ' ' LEU . 20.0 m-85 -105.06 127.15 52.75 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.327 -0.62 . . . . 65.41 109.327 179.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -111.55 116.75 31.36 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.109 0.481 . . . . 70.22 110.048 176.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 25.9 p -138.74 158.21 44.65 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.678 -0.692 . . . . 62.23 110.042 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.511 ' HB3' ' HG2' ' A' ' 509' ' ' ARG . 7.8 pt-20 -161.24 170.55 20.04 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.368 -0.378 . . . . 72.21 110.16 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.657 HG21 ' HB3' ' A' ' 482' ' ' ALA . 19.9 m -126.16 168.48 19.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 115.641 -0.708 . . . . 73.22 109.827 177.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 7.8 t -81.26 -1.05 43.49 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.439 -0.346 . . . . 42.11 111.322 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -117.2 133.96 55.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.087 0.47 . . . . 73.41 110.691 -179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -71.75 124.78 25.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.99 -0.55 . . . . 74.42 111.668 -175.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 71.72 31.91 64.62 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 121.108 -0.568 . . . . 71.12 113.284 174.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.657 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -81.56 133.37 35.37 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 122.607 -0.349 . . . . 74.43 110.535 176.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -68.23 142.49 55.62 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.695 -0.684 . . . . 74.44 110.395 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.524 HG12 HG22 ' A' ' 529' ' ' THR . 27.4 m -124.9 146.34 30.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 121.198 0.523 . . . . 71.1 110.76 179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -117.9 135.53 54.05 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.412 -0.813 . . . . 74.43 109.053 177.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . 0.577 ' HB3' HD12 ' A' ' 493' ' ' LEU . 99.2 m95 -98.05 121.42 39.95 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.219 0.533 . . . . 75.05 110.312 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 20.2 tp -116.11 151.68 35.13 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.409 -0.814 . . . . 73.01 109.292 -178.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -136.86 105.22 5.73 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 120.803 0.335 . . . . 73.34 110.454 179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 16.0 t70 47.13 40.22 9.49 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.326 -0.852 . . . . 74.44 111.663 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.47 -26.3 24.38 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 120.808 -0.711 . . . . 71.44 113.212 178.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 57.9 t -91.64 135.82 26.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 110.032 -0.359 . . . . 51.5 110.032 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -83.53 136.08 34.4 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.522 0.201 . . . . 75.52 110.564 -177.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.577 HD12 ' HB3' ' A' ' 486' ' ' TRP . 70.1 mt -69.09 153.89 42.98 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.946 -0.39 . . . . 72.22 109.946 178.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . 0.522 HG22 ' HG2' ' A' ' 496' ' ' GLU . 1.3 m -74.98 142.19 43.92 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.19 0.519 . . . . 74.4 112.104 -170.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 10.6 ptp85 -68.44 -20.75 64.66 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.744 -0.662 . . . . 75.04 110.431 175.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . 0.522 ' HG2' HG22 ' A' ' 494' ' ' THR . 9.1 pt-20 -116.52 39.11 3.23 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.278 -0.874 . . . . 73.14 109.204 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 494' ' ' THR . 7.3 tp10 -62.85 154.88 28.64 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.192 -0.913 . . . . 70.54 111.568 -174.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 9.6 t -60.22 150.6 29.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.511 -0.768 . . . . 73.44 111.396 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -86.23 18.25 3.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.002 -0.544 . . . . 71.22 111.248 -176.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . 0.418 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 39.6 tttp -72.61 -24.24 61.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.358 -0.608 . . . . 71.1 109.358 177.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.483 ' CB ' ' HA ' ' A' ' 514' ' ' ILE . 13.4 p90 -146.14 138.52 25.33 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.285 -0.871 . . . . 64.21 108.96 173.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -135.39 160.24 39.05 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.855 0.359 . . . . 70.14 111.446 -174.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . 0.439 ' HB3' HD13 ' A' ' 512' ' ' LEU . 40.8 p90 -119.17 138.26 53.06 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.115 0.483 . . . . 75.34 110.734 -179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -116.89 131.4 56.96 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.707 -0.678 . . . . 60.23 110.274 -178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -101.53 128.47 47.76 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.419 -0.355 . . . . 71.25 110.653 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -135.56 81.75 1.91 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.075 -0.511 . . . . 64.05 109.742 174.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 75.14 -118.0 5.47 Favored Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 121.007 -0.616 . . . . 75.05 112.151 -178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -86.11 -13.88 45.9 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.94 0.4 . . . . 75.31 110.407 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.511 ' HG2' ' HB3' ' A' ' 476' ' ' GLU . 70.6 mtt180 -97.58 139.14 33.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.408 0.623 . . . . 74.14 111.497 -174.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -130.44 119.18 22.29 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.401 -0.818 . . . . 70.22 109.638 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 41.7 m-70 -105.54 124.91 50.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.438 -0.346 . . . . 63.43 110.189 -177.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.714 HD23 ' HD2' ' A' ' 473' ' ' PHE . 50.6 tp -106.31 105.86 16.1 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.696 -0.483 . . . . 71.03 109.696 176.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.55 HG23 ' HG2' ' A' ' 472' ' ' GLU . 4.8 mp -101.75 110.6 28.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 116.187 -0.461 . . . . 71.33 110.622 -174.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.483 ' HA ' ' CB ' ' A' ' 501' ' ' TYR . 55.4 mt -92.4 116.99 34.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 108.575 -0.898 . . . . 74.5 108.575 173.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -70.64 -42.76 70.43 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.1 -0.5 . . . . 61.24 111.345 -175.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . 0.418 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 26.2 mt-10 -134.17 105.24 6.56 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.871 -0.604 . . . . 63.42 109.627 -178.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.469 ' O ' HG13 ' A' ' 467' ' ' VAL . . . -56.53 123.04 13.43 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.548 0.53 . . . . 60.11 110.306 177.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 14.4 tpt -113.81 169.09 9.24 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.133 -0.485 . . . . 73.21 110.111 -175.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 1.004 ' HG ' ' HG2' ' A' ' 542' ' ' GLU . 7.2 mp -58.12 -33.04 68.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.108 0.48 . . . . 55.51 110.491 178.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -60.91 -32.48 71.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.473 -0.785 . . . . 74.14 112.233 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -69.32 -14.23 62.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.766 0.317 . . . . 75.3 111.818 -172.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -62.71 -23.23 67.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.086 0.469 . . . . 74.2 110.088 172.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -67.54 123.73 20.35 Favored Glycine 0 N--CA 1.448 -0.55 0 N-CA-C 110.824 -0.91 . . . . 23.21 110.824 173.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -66.76 125.74 26.82 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.127 0.489 . . . . 45.12 111.694 -170.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -92.95 152.48 19.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.594 -0.73 . . . . 65.14 110.522 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -136.51 143.24 43.66 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.965 -0.561 . . . . 74.1 110.744 179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.499 ' HB2' HD21 ' A' ' 460' ' ' LEU . 58.6 tp -100.97 114.13 27.75 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.049 -0.523 . . . . 61.32 109.907 179.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 42.3 t -112.89 128.82 56.57 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.191 -0.459 . . . . 63.4 110.08 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.524 HG22 HG12 ' A' ' 484' ' ' VAL . 75.8 p -114.69 -174.3 2.46 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.492 -0.559 . . . . 74.11 109.492 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 12.4 p -68.0 -8.93 41.57 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.65 -0.25 . . . . 60.2 111.575 179.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -143.68 -48.55 0.04 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.705 -0.759 . . . . 21.33 113.301 -178.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -98.74 156.97 20.22 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.646 -0.788 . . . . 54.0 113.121 -174.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -131.99 125.43 31.52 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.368 0.267 . . . . 73.33 110.292 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . 0.588 ' HB2' HG13 ' A' ' 456' ' ' ILE . . . -121.53 118.1 28.45 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.708 -0.224 . . . . 53.43 110.791 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 64.0 tp -109.66 138.96 45.27 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.996 0.427 . . . . 74.41 110.622 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -139.52 145.17 38.38 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.758 -0.656 . . . . 24.4 109.557 176.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -105.63 110.0 22.16 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.544 0.688 . . . . 73.31 110.458 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.559 HD11 HG22 ' A' ' 465' ' ' VAL . 49.1 tp -103.39 132.58 49.53 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.534 -0.757 . . . . 72.2 110.037 179.007 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.555 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 67.8 mt -117.85 112.92 40.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.723 -0.473 . . . . 72.52 109.723 176.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.438 HG22 HG23 ' A' ' 465' ' ' VAL . 45.8 t -108.39 108.65 25.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.302 -0.408 . . . . 75.41 110.244 -179.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -85.55 134.08 34.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.921 0.391 . . . . 63.43 110.41 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . 1.004 ' HG2' ' HG ' ' A' ' 519' ' ' LEU . 1.0 OUTLIER -83.95 149.82 26.06 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.706 -0.679 . . . . 62.23 111.404 -174.325 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 C--O 1.249 1.046 0 CA-C-N 115.58 -0.736 . . . . 75.21 109.532 175.234 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.698 0 N-CA-C 112.03 -0.428 . . . . 62.43 112.03 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 41.2 t -82.57 -75.04 0.32 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.032 0.444 . . . . 73.14 110.098 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 30.0 m-70 -124.28 13.87 8.94 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.302 0.573 . . . . 74.52 110.063 176.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . 0.46 ' HA ' ' HD3' ' A' ' 453' ' ' PRO . 25.9 mmt -88.37 138.12 30.46 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 115.508 -0.769 . . . . 74.24 109.361 176.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 452' ' ' MET . 25.4 Cg_exo -62.96 159.15 39.62 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 122.701 2.268 . . . . 62.4 112.494 -178.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.452 ' H ' ' HA3' ' A' ' 531' ' ' GLY . 57.3 t -66.87 116.11 5.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.982 -0.553 . . . . 73.51 109.583 175.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 86.2 mt -95.31 153.14 17.82 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.045 0.45 . . . . 70.24 110.977 -174.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.416 HG22 ' H ' ' A' ' 458' ' ' ARG . 27.7 mm -105.76 117.83 52.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.785 -0.643 . . . . 74.14 109.733 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . 0.58 ' CG2' ' HB2' ' A' ' 476' ' ' GLU . 15.1 t -91.26 2.63 56.23 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.271 0.558 . . . . 65.33 110.763 -177.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.428 ' HB2' ' H ' ' A' ' 476' ' ' GLU . 75.4 mmt-85 -138.84 94.5 10.14 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.708 -0.678 . . . . 71.21 109.663 173.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -67.45 157.31 62.37 Favored 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 122.479 2.12 . . . . 70.32 111.467 178.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.434 HD12 ' HB3' ' A' ' 473' ' ' PHE . 3.1 mm? -80.96 146.66 30.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.357 -0.609 . . . . 53.3 109.357 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . 0.657 ' HB2' ' OE1' ' A' ' 463' ' ' GLN . 6.0 pt-20 -82.91 126.77 32.86 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.968 0.889 . . . . 73.12 112.462 -171.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -92.55 -6.94 48.58 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 113.934 -1.485 . . . . 64.25 112.791 -173.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . 0.657 ' OE1' ' HB2' ' A' ' 461' ' ' GLU . 4.6 pm0 -83.73 161.33 21.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.294 0.569 . . . . 75.2 110.954 -169.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.834 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 1.2 tt -84.72 132.1 34.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.339 -0.846 . . . . 63.2 111.609 -161.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 33.0 m -120.81 177.73 3.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.357 -0.838 . . . . 63.0 109.693 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . 0.453 ' O ' ' HB3' ' A' ' 469' ' ' GLN . 23.0 ptp -124.5 163.11 22.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.696 0.284 . . . . 75.01 111.017 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 541' ' ' GLN . 59.6 t -62.53 130.31 26.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 70.13 111.179 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . 0.445 ' HA2' ' HB3' ' A' ' 516' ' ' GLU . . . 93.48 -11.88 70.65 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.937 -0.649 . . . . 72.43 112.353 178.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.453 ' HB3' ' O ' ' A' ' 466' ' ' MET . 29.5 tt0 -76.31 132.37 39.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.951 0.405 . . . . 72.12 111.035 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -73.86 127.04 31.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.609 -0.723 . . . . 74.04 110.251 177.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 47.5 t -132.52 126.86 55.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.202 -0.454 . . . . 65.24 110.601 -178.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -103.86 131.07 51.42 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.126 -0.324 . . . . 72.34 110.126 174.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.434 ' HB3' HD12 ' A' ' 460' ' ' LEU . 55.0 m-85 -107.07 110.98 23.24 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.124 -0.489 . . . . 71.43 109.748 176.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -104.97 129.86 53.29 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.346 -0.388 . . . . 73.41 110.296 -178.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . . . . . . . . . 9.0 p -143.46 111.68 6.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.219 0.533 . . . . 64.13 110.292 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.58 ' HB2' ' CG2' ' A' ' 457' ' ' THR . 2.0 mm-40 -108.51 132.23 54.03 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.125 -0.694 . . . . 74.24 109.125 -178.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.458 HG22 ' O ' ' A' ' 508' ' ' GLN . 34.9 m -95.33 144.64 9.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 110.044 -0.354 . . . . 63.4 110.044 179.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 58.9 p -85.79 -2.59 58.38 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.81 0.338 . . . . 63.22 111.446 -177.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -124.04 133.16 53.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.334 -0.394 . . . . 73.11 110.222 -178.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -77.98 150.13 33.98 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 110.018 -0.364 . . . . 65.43 110.018 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 84.41 16.29 66.86 Favored Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 120.495 -0.859 . . . . 41.34 112.116 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.44 110.89 22.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.964 0.411 . . . . 72.01 110.535 177.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 529' ' ' THR . 27.2 mp0 -80.97 157.92 25.37 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.126 -0.694 . . . . 71.12 109.126 177.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.554 HG12 HG22 ' A' ' 529' ' ' THR . 24.5 m -128.1 143.16 41.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 121.246 0.546 . . . . 62.21 111.579 -175.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 21.5 ttmm -127.59 131.69 49.92 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.404 -0.816 . . . . 72.25 109.37 174.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . 0.462 ' HB2' HD11 ' A' ' 493' ' ' LEU . 98.0 m95 -98.17 115.91 29.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.303 0.573 . . . . 74.22 110.258 178.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 37.3 tp -116.63 120.89 40.08 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.342 -0.844 . . . . 73.22 109.501 -179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.473 ' HE2' ' HA3' ' A' ' 523' ' ' GLY . 13.3 tmtt? -109.44 106.65 16.49 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 120.466 -0.494 . . . . 73.4 110.311 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.08 38.31 20.36 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.164 -0.926 . . . . 73.3 111.808 175.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.73 -24.16 32.12 Favored Glycine 0 C--N 1.331 0.25 0 C-N-CA 120.87 -0.681 . . . . 71.14 112.586 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.6 t -89.7 124.84 42.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 110.072 -0.344 . . . . 64.12 110.072 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -89.62 119.66 30.24 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.428 -0.582 . . . . 64.24 109.428 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.462 HD11 ' HB2' ' A' ' 486' ' ' TRP . 2.4 pp -72.73 161.64 30.49 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.199 -0.455 . . . . 65.12 111.395 -177.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . 0.5 ' O ' ' HB2' ' A' ' 497' ' ' GLU . 19.1 m -106.85 142.72 36.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.98 -0.554 . . . . 75.42 110.241 -178.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . 0.415 ' HD3' ' C ' ' A' ' 495' ' ' ARG . 4.3 tmt_? -65.19 -39.91 93.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.345 -0.613 . . . . 64.35 109.345 176.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . 0.439 ' H ' HG22 ' A' ' 494' ' ' THR . 1.3 mp0 -76.25 73.14 3.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.936 -0.575 . . . . 62.23 109.898 171.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . 0.5 ' HB2' ' O ' ' A' ' 494' ' ' THR . 5.0 tp10 -120.21 179.58 4.25 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.585 -0.734 . . . . 75.23 109.44 -177.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.426 ' H ' ' HG3' ' A' ' 497' ' ' GLU . 11.2 t -72.5 172.64 10.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.703 0.287 . . . . 72.55 110.345 175.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 49.8 p90 -79.13 18.21 0.68 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.816 0.341 . . . . 72.41 111.791 -173.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -61.4 -35.13 76.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 72.35 111.189 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.534 ' HD2' HD11 ' A' ' 512' ' ' LEU . 25.1 p90 -148.57 150.2 32.92 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.297 -0.411 . . . . 74.22 110.616 -177.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -146.6 142.64 28.16 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.479 -0.563 . . . . 72.45 109.479 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . 0.51 ' HB3' HD13 ' A' ' 512' ' ' LEU . 44.1 p90 -123.3 150.03 44.07 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.131 0.491 . . . . 74.33 111.34 -176.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -127.92 139.7 52.44 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.368 -0.833 . . . . 64.11 110.023 177.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.2 pptp? -111.07 137.78 48.3 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.691 -0.485 . . . . 75.43 109.691 173.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . 0.633 ' HB3' ' HB2' ' A' ' 509' ' ' ARG . 33.8 t70 -130.45 82.86 2.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.784 -0.644 . . . . 75.25 109.382 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.34 -107.99 2.25 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 120.704 -0.76 . . . . 65.34 111.661 -174.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.458 ' O ' HG22 ' A' ' 477' ' ' VAL . 15.9 pt20 -89.32 -7.44 55.33 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.454 0.645 . . . . 74.11 110.151 177.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.633 ' HB2' ' HB3' ' A' ' 506' ' ' ASP . 67.8 mtp180 -91.08 147.12 23.29 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.641 -0.709 . . . . 71.44 111.071 -172.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 74.3 m-70 -141.72 115.72 9.29 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.36 -0.607 . . . . 75.32 109.36 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -124.33 122.51 37.91 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.68 0.276 . . . . 64.32 110.574 -175.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.534 HD11 ' HD2' ' A' ' 501' ' ' TYR . 57.4 tp -107.86 126.54 52.79 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.137 -0.483 . . . . 52.02 110.315 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.42 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.2 mp -108.76 113.84 45.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 120.954 0.406 . . . . 73.44 110.737 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . . . . . . . . . 35.5 mm -91.36 121.84 42.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.874 -0.787 . . . . 72.41 108.874 174.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . 0.447 HD22 ' N ' ' A' ' 515' ' ' ASN . 0.9 OUTLIER -66.64 -51.49 55.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.81 0.338 . . . . 72.24 110.397 -177.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . 0.445 ' HB3' ' HA2' ' A' ' 468' ' ' GLY . 46.4 mt-10 -145.4 123.55 12.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.917 -0.583 . . . . 72.45 110.131 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -66.48 133.71 50.95 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.128 -0.487 . . . . 50.34 110.999 178.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . 0.449 ' HG2' ' H ' ' A' ' 520' ' ' GLU . 55.1 ttm -113.67 155.96 24.58 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.891 -0.595 . . . . 75.44 109.621 -178.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.702 HD21 ' HB3' ' A' ' 542' ' ' GLU . 84.8 mt -58.81 -32.5 69.43 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.935 0.397 . . . . 51.24 111.623 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' A' ' 518' ' ' MET . 0.9 OUTLIER -60.41 -28.58 68.37 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 121.143 0.497 . . . . 74.01 110.691 178.454 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . 0.454 ' C ' ' H ' ' A' ' 523' ' ' GLY . 56.7 m-20 -71.32 -11.95 61.18 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.767 -0.651 . . . . 74.43 112.197 -175.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.489 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -61.66 5.54 0.08 Allowed 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.576 0.584 . . . . 72.02 112.576 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . 0.473 ' HA3' ' HE2' ' A' ' 488' ' ' LYS . . . -83.91 170.56 47.81 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 116.415 -0.357 . . . . 71.15 112.367 177.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 44.4 m-70 -73.69 118.56 16.79 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 122.65 -0.324 . . . . 72.21 110.559 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . 0.441 ' HB2' ' O ' ' A' ' 536' ' ' ALA . 56.8 m-85 -83.75 133.73 34.77 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.957 -0.386 . . . . 72.45 109.957 172.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.57 134.23 46.84 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.867 0.365 . . . . 70.14 110.514 175.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.548 HD11 ' HB ' ' A' ' 484' ' ' VAL . 57.1 tp -110.33 106.52 15.93 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.866 -0.606 . . . . 72.4 109.939 177.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 48.7 m -92.52 115.11 27.8 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.218 -0.446 . . . . 73.42 110.113 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.554 HG22 HG12 ' A' ' 484' ' ' VAL . 44.3 p -109.11 -175.01 2.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.909 0.385 . . . . 73.54 110.601 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 14.5 m -72.65 -5.92 40.8 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.082 -0.508 . . . . 74.32 110.965 175.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . 0.452 ' HA3' ' H ' ' A' ' 454' ' ' VAL . . . -138.43 -90.38 0.22 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.653 -0.784 . . . . 75.22 112.785 -178.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -97.46 127.28 9.16 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.631 -0.795 . . . . 51.2 112.455 -177.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -95.55 127.1 41.31 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.059 0.457 . . . . 71.14 110.814 178.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -97.23 140.03 32.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.006 -0.543 . . . . 72.41 110.044 178.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 6.0 tt -129.58 123.78 32.18 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.724 -0.473 . . . . 75.3 109.724 -178.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.441 ' O ' ' HB2' ' A' ' 525' ' ' TYR . . . -145.07 134.76 23.43 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.724 -0.671 . . . . 74.4 109.687 177.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . 0.438 ' H ' ' HG2' ' A' ' 537' ' ' GLU . 4.4 pt-20 -105.17 137.72 42.5 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 120.844 0.354 . . . . 73.02 110.474 -176.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 522' ' ' ALA . 45.4 tp -96.4 133.95 40.17 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.879 -0.601 . . . . 60.22 110.201 -174.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.834 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 7.6 mt -104.06 123.78 58.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 108.98 -0.748 . . . . 63.43 108.98 177.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 45.6 t -118.74 126.37 75.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.584 -0.28 . . . . 75.11 111.22 -174.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . 0.574 ' HG3' ' CD2' ' A' ' 464' ' ' LEU . 74.8 mt-30 -84.82 127.73 34.28 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 116.361 -0.381 . . . . 73.13 111.189 175.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . 0.702 ' HB3' HD21 ' A' ' 519' ' ' LEU . 6.9 pt-20 -91.12 126.81 36.32 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 107.512 -1.292 . . . . 74.22 107.512 163.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 22.5 mtpp . . . . . 0 C--N 1.315 -0.92 0 CA-C-O 118.865 -0.588 . . . . 62.24 109.736 -176.609 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 111.361 -0.696 . . . . 70.15 111.361 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 17.3 m -78.95 140.37 38.05 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.619 -0.512 . . . . 73.02 109.619 176.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -68.32 146.06 53.63 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.747 -0.381 . . . . 71.33 110.31 -179.308 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 66.4 mtt -63.92 154.26 82.0 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 116.059 -0.519 . . . . 71.14 110.141 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.53 148.03 21.52 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.812 2.341 . . . . 71.21 111.794 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.418 ' H ' ' HA3' ' A' ' 531' ' ' GLY . 43.1 t -66.26 106.34 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.112 -0.494 . . . . 63.41 110.219 -177.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 93.6 mt -82.57 147.29 28.7 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.605 -0.725 . . . . 73.41 110.163 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.788 HG13 ' HB2' ' A' ' 534' ' ' ALA . 40.7 mm -94.79 117.35 38.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-N 115.942 -0.572 . . . . 73.41 109.908 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . 0.496 HG22 ' NH2' ' A' ' 458' ' ' ARG . 3.3 m -83.28 -35.63 25.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.218 -0.447 . . . . 70.34 110.583 -177.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.717 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 14.2 mmp_? -115.42 105.57 52.04 Favored Pre-proline 0 C--N 1.329 -0.324 0 N-CA-C 109.566 -0.531 . . . . 74.12 109.566 176.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -70.75 160.61 48.85 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 122.784 2.323 . . . . 64.22 111.785 178.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.481 ' HB2' ' CB ' ' A' ' 536' ' ' ALA . 94.8 mt -81.77 169.4 16.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.763 0.316 . . . . 65.33 110.98 -177.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -64.7 118.12 8.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.961 -0.563 . . . . 43.13 111.444 -175.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -94.76 -11.75 28.43 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.865 -0.607 . . . . 72.42 111.503 177.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -89.51 159.73 17.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.196 0.522 . . . . 74.24 111.778 -171.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.41 HD23 ' C ' ' A' ' 464' ' ' LEU . 8.4 tt -85.81 137.06 33.05 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.51 -0.768 . . . . 74.32 110.258 -173.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.628 HG23 HG23 ' A' ' 540' ' ' VAL . 22.8 m -130.45 175.99 9.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.623 -0.717 . . . . 64.44 110.476 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . 0.493 ' O ' ' HG2' ' A' ' 469' ' ' GLN . 65.8 mtt -111.21 150.74 29.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.638 0.256 . . . . 70.5 110.975 -178.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.5 142.56 16.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.303 -0.408 . . . . 41.43 110.72 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.06 -25.49 28.12 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.946 -0.645 . . . . 42.22 113.635 175.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 466' ' ' MET . 13.1 pt20 -89.26 164.82 14.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 117.25 0.525 . . . . 64.44 110.444 -178.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 514' ' ' ILE . 33.9 ttm180 -88.81 129.39 35.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.909 0.385 . . . . 71.55 111.215 -174.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -124.92 139.92 49.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.495 . . . . 72.11 110.206 -177.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -125.69 134.12 51.93 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.753 0.311 . . . . 55.42 110.643 -178.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.767 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 81.8 m-85 -107.12 116.32 31.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.207 -0.451 . . . . 70.04 110.625 177.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -100.06 118.14 35.81 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.628 -0.715 . . . . 71.24 109.606 177.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.717 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 27.6 t -134.89 141.29 46.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.299 0.571 . . . . 64.34 111.305 -178.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.621 ' HG3' ' HG2' ' A' ' 509' ' ' ARG . 42.7 tt0 -138.45 136.85 36.62 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.298 -1.001 . . . . 74.34 108.298 176.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.531 HG21 ' HB3' ' A' ' 482' ' ' ALA . 18.0 m -104.07 154.68 5.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 C-N-CA 121.167 -0.213 . . . . 64.22 110.459 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 45.4 m -82.61 -2.22 53.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.814 0.34 . . . . 74.21 111.622 -178.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -111.21 141.29 44.92 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.612 -0.514 . . . . 73.14 109.612 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -86.24 138.41 31.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.153 -0.476 . . . . 74.42 111.202 -173.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 62.13 39.1 97.2 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.922 -0.656 . . . . 65.43 112.212 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.531 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -103.34 112.03 24.72 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.078 0.466 . . . . 71.14 111.065 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -73.31 154.31 40.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.594 -0.73 . . . . 73.33 109.594 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.423 HG12 HG22 ' A' ' 529' ' ' THR . 35.7 m -124.63 161.26 28.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 120.897 0.379 . . . . 72.55 111.022 -175.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 527' ' ' LEU . 12.3 ttmm -116.64 128.77 55.69 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.731 -0.668 . . . . 44.45 109.682 177.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . 0.41 ' HB2' HD21 ' A' ' 493' ' ' LEU . 89.9 m95 -98.82 115.35 28.61 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.306 -0.627 . . . . 75.53 109.306 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 28.6 tp -119.6 119.2 33.07 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.032 -0.531 . . . . 63.11 110.393 -177.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.481 ' O ' ' HD3' ' A' ' 488' ' ' LYS . 13.3 tmtt? -109.74 106.79 16.56 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.013 -0.366 . . . . 71.33 110.013 177.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.1 t70 49.19 38.46 13.32 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.461 0.648 . . . . 74.21 111.491 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.45 -17.21 58.81 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.707 -0.759 . . . . 64.12 113.014 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.6 t -84.89 117.14 29.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.803 0.302 . . . . 74.34 110.729 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -97.89 117.67 32.75 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.44 -0.578 . . . . 53.53 109.44 176.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.41 HD21 ' HB2' ' A' ' 486' ' ' TRP . 1.9 pp -73.97 163.11 28.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.177 0.513 . . . . 73.54 112.008 -175.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 34.9 p -106.72 174.42 5.89 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.619 -0.719 . . . . 70.12 111.541 -177.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 52.8 ttp180 -63.14 -47.47 82.58 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.324 0.583 . . . . 75.22 111.202 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -95.52 50.51 1.24 Allowed 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.824 -0.625 . . . . 74.33 110.23 -176.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -76.45 169.75 17.67 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.905 -0.589 . . . . 72.32 110.649 -176.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 4.7 t -57.75 150.97 18.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.155 0.502 . . . . 55.51 111.898 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 34.0 p90 -85.19 7.21 22.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.862 -0.608 . . . . 72.12 111.123 -179.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . 0.485 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 54.3 tptt -62.06 -37.34 84.63 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.483 0.659 . . . . 75.0 109.337 174.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.519 ' HB2' HG12 ' A' ' 514' ' ' ILE . 8.4 p90 -152.19 131.64 12.96 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.954 -1.021 . . . . 71.54 108.681 175.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -139.0 161.51 37.18 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.096 0.474 . . . . 72.12 111.755 -175.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -119.0 139.64 51.35 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.834 -0.621 . . . . 70.35 110.755 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.427 ' HE2' ' HB3' ' A' ' 504' ' ' LYS . 40.7 mtpt -127.59 149.69 50.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.11 -0.495 . . . . 75.11 109.921 176.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.456 ' O ' ' HD3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -106.62 146.9 30.14 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.2 0.524 . . . . 73.32 111.478 -176.108 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -147.31 99.07 3.1 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.361 -0.836 . . . . 63.01 109.546 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 61.83 -123.65 32.16 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.453 -0.88 . . . . 51.25 111.107 -173.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -96.92 7.34 46.85 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.172 0.51 . . . . 74.43 110.423 175.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.621 ' HG2' ' HG3' ' A' ' 476' ' ' GLU . 74.8 mtm180 -95.26 152.29 18.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.044 -0.525 . . . . 60.32 110.032 177.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -136.94 128.25 28.17 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.966 -0.383 . . . . 50.33 109.966 -178.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 -111.01 123.91 51.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.515 -0.311 . . . . 63.13 110.198 -179.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.767 ' HB3' ' HB2' ' A' ' 473' ' ' PHE . 58.2 tp -110.28 104.47 13.28 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.511 -0.551 . . . . 45.3 109.511 174.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.432 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.3 mp -101.38 115.55 43.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 116.239 -0.437 . . . . 73.0 110.515 -175.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.527 ' O ' ' HG3' ' A' ' 470' ' ' ARG . 51.8 mt -97.74 119.42 45.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.898 -0.779 . . . . 75.54 108.898 173.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -69.1 -39.56 78.9 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.366 -0.379 . . . . 73.23 110.88 -177.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . 0.485 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 41.4 mt-10 -146.83 113.17 5.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.908 -0.587 . . . . 71.12 109.617 178.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -58.43 143.23 46.08 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 123.517 0.511 . . . . 71.13 111.385 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 88.0 mtp -123.38 172.9 8.33 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.102 -0.499 . . . . 64.02 110.301 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.477 HD13 ' O ' ' A' ' 519' ' ' LEU . 2.6 tm? -60.7 -31.36 70.64 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.956 -0.387 . . . . 65.54 109.956 177.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -52.44 -28.62 20.76 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.073 -0.512 . . . . 71.13 111.87 177.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . 0.556 ' HA ' ' HE1' ' A' ' 525' ' ' TYR . 42.6 m-20 -68.16 -15.38 63.56 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.379 -0.373 . . . . 73.03 111.802 -177.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.52 ' HB2' HG12 ' A' ' 540' ' ' VAL . . . -71.04 -12.86 61.76 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.13 0.49 . . . . 73.15 110.225 174.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -77.66 156.53 44.6 Favored Glycine 0 N--CA 1.443 -0.876 0 N-CA-C 111.138 -0.785 . . . . 30.53 111.138 176.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 39.7 m170 -81.79 117.19 21.89 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.189 0.518 . . . . 64.52 111.044 -176.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . 0.556 ' HE1' ' HA ' ' A' ' 521' ' ' ASP . 73.4 m-85 -88.96 133.76 34.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.205 -0.907 . . . . 74.24 110.667 179.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -123.59 135.02 53.74 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.081 -0.509 . . . . 73.25 110.36 176.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.434 ' HA ' ' O ' ' A' ' 485' ' ' LYS . 9.4 tt -109.8 111.0 22.17 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.883 -0.784 . . . . 74.13 108.883 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 42.1 t -109.5 136.31 49.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.29 -0.414 . . . . 71.2 110.721 -176.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.423 HG22 HG12 ' A' ' 484' ' ' VAL . 82.3 p -118.22 -175.65 2.9 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.69 -0.485 . . . . 73.4 109.69 175.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 13.7 m -69.18 -9.08 51.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.761 0.315 . . . . 74.31 110.942 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . 0.418 ' HA3' ' H ' ' A' ' 454' ' ' VAL . . . -124.85 -65.97 0.19 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.395 -0.907 . . . . 75.22 112.896 -177.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -113.52 171.45 13.84 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.676 -0.773 . . . . 61.1 112.498 -176.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -138.62 130.34 27.78 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.775 0.321 . . . . 71.1 110.561 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . 0.788 ' HB2' HG13 ' A' ' 456' ' ' ILE . . . -109.47 120.97 44.12 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.209 -0.451 . . . . 72.14 110.157 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 5.3 tt -109.05 121.2 44.64 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.093 -0.706 . . . . 64.23 109.093 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.481 ' CB ' ' HB2' ' A' ' 460' ' ' LEU . . . -119.2 132.13 55.91 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.065 0.46 . . . . 73.33 110.478 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -99.46 108.73 21.26 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.38 0.61 . . . . 73.43 109.691 179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.453 HD23 ' HB3' ' A' ' 521' ' ' ASP . 37.0 tp -97.78 136.1 38.6 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.331 -0.85 . . . . 75.2 109.459 -177.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . . . . . . . . . 31.5 mt -113.03 112.36 40.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.84 -0.43 . . . . 63.25 109.84 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.628 HG23 HG23 ' A' ' 465' ' ' VAL . 4.4 p -113.91 133.34 60.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 108.803 -0.814 . . . . 73.25 108.803 176.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -110.21 148.18 32.34 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.107 0.479 . . . . 73.4 111.407 -176.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -70.36 146.97 50.1 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.012 -0.994 . . . . 60.11 110.786 -178.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . 0.46 ' HD2' ' HB3' ' A' ' 466' ' ' MET . 55.9 mtpt . . . . . 0 C--O 1.244 0.803 0 CA-C-O 118.629 -0.7 . . . . 72.24 109.323 175.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.652 0 N-CA-C 111.78 -0.528 . . . . 52.11 111.78 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 11.4 t -122.65 153.7 39.01 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.786 -0.45 . . . . 70.31 109.786 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -78.07 69.22 4.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.15 0.5 . . . . 74.1 110.047 178.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 17.6 tpt -98.54 117.45 64.61 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 115.681 -0.69 . . . . 71.14 109.943 -179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -58.48 147.19 87.39 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.781 2.321 . . . . 51.43 112.068 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 7.2 p -66.68 132.35 32.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.991 -0.55 . . . . 74.11 110.674 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.9 137.26 34.3 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.922 -0.581 . . . . 73.52 110.857 -179.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.566 HD13 HG12 ' A' ' 477' ' ' VAL . 32.9 mm -95.43 119.08 43.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.734 -0.666 . . . . 73.34 109.717 177.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . 0.783 ' HB ' ' HG3' ' A' ' 476' ' ' GLU . 7.5 m -86.89 -23.54 25.18 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 73.21 111.18 -177.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.824 ' HG2' ' HG2' ' A' ' 476' ' ' GLU . 22.5 mmt180 -123.35 117.32 28.04 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 116.598 -0.274 . . . . 65.33 111.671 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -83.42 167.12 13.71 Favored 'Trans proline' 0 N--CA 1.455 -0.772 0 C-N-CA 123.02 2.48 . . . . 75.42 111.414 173.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -89.49 169.96 10.92 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.617 0.246 . . . . 40.33 110.87 -178.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -71.18 118.64 14.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.275 -0.42 . . . . 65.21 110.453 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -93.94 -13.47 27.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.171 -0.468 . . . . 64.02 111.27 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -89.66 155.32 19.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.136 0.493 . . . . 62.01 111.131 -173.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 8.0 tt -88.95 133.13 34.41 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.708 -0.678 . . . . 70.32 110.352 -173.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 28.7 m -127.49 176.67 6.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.188 -0.46 . . . . 63.21 111.035 -177.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . . . . . . . . . 26.4 mmt -113.86 152.91 30.05 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.323 -0.399 . . . . 75.41 111.272 -176.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . 0.408 HG13 ' O ' ' A' ' 517' ' ' ALA . 83.1 t -68.14 144.69 14.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.549 -0.751 . . . . 71.01 110.787 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.52 -2.26 53.39 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.911 -0.661 . . . . 45.24 113.973 175.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -114.57 164.34 14.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.471 0.636 . . . . 54.02 110.475 177.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 27.2 ttt85 -84.92 132.88 34.31 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.975 0.417 . . . . 74.54 111.166 -177.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.494 ' O ' ' HB ' ' A' ' 514' ' ' ILE . 50.5 t -131.67 138.57 52.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.862 -0.608 . . . . 52.42 109.605 177.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -131.78 139.44 48.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.778 0.323 . . . . 64.22 110.461 -179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.461 ' HB2' ' HB3' ' A' ' 512' ' ' LEU . 93.5 m-85 -121.27 109.61 15.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.929 -0.578 . . . . 64.41 110.154 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -106.43 117.09 33.13 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 119.909 -0.716 . . . . 62.42 109.467 173.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.768 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 7.7 p -122.8 123.41 40.98 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.555 -0.748 . . . . 62.11 109.974 -178.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.824 ' HG2' ' HG2' ' A' ' 458' ' ' ARG . 13.3 pt-20 -125.42 145.09 50.22 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.909 0.385 . . . . 74.43 110.239 -177.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.566 HG12 HD13 ' A' ' 456' ' ' ILE . 17.9 m -111.49 164.63 7.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.782 -0.645 . . . . 71.32 109.543 178.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 15.6 t -78.16 -18.0 56.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.728 0.299 . . . . 74.14 111.214 -178.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . 0.41 ' O ' HG23 ' A' ' 477' ' ' VAL . 44.6 tt0 -103.31 131.94 49.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.817 0.341 . . . . 72.14 110.422 -178.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . 0.517 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 43.2 tt0 -89.17 131.56 35.25 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.854 0.359 . . . . 60.51 110.164 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 98.78 -1.42 58.14 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.801 -0.714 . . . . 54.13 111.523 -176.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.536 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -79.57 112.01 16.41 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.055 0.455 . . . . 74.33 110.625 178.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -81.78 147.15 29.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.647 -0.706 . . . . 75.25 110.805 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 28.9 m -126.96 153.24 35.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.006 -0.543 . . . . 65.5 110.459 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -119.23 145.72 45.82 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.644 -0.502 . . . . 71.23 109.644 178.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -98.6 129.37 45.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.305 0.574 . . . . 74.51 110.909 -178.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . 0.648 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 2.6 tm? -116.24 131.73 56.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.277 -0.874 . . . . 75.33 108.846 -177.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.437 ' HE3' ' HA3' ' A' ' 523' ' ' GLY . 1.2 tmtp? -120.55 107.32 12.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.898 0.38 . . . . 70.01 111.446 -178.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 53.72 37.72 26.83 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.379 -0.828 . . . . 62.24 111.993 172.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 96.99 -24.04 33.01 Favored Glycine 0 CA--C 1.517 0.196 0 C-N-CA 120.751 -0.738 . . . . 63.14 112.553 179.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 48.9 t -97.28 127.87 49.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 120.725 0.298 . . . . 44.32 110.417 -178.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -86.65 131.85 34.04 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.82 -0.437 . . . . 63.2 109.82 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 3.3 pp -112.14 162.96 14.86 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.072 0.463 . . . . 51.14 111.256 -177.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 22.2 p -108.19 173.91 6.11 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.906 -0.588 . . . . 61.22 109.701 175.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . 0.639 ' HD3' ' CE2' ' A' ' 503' ' ' PHE . 13.9 tpt180 -80.9 -4.41 54.77 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.077 0.465 . . . . 63.33 110.467 -178.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -74.07 75.69 1.74 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.193 0.52 . . . . 73.53 110.48 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -145.47 170.7 15.87 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.824 -0.625 . . . . 74.41 109.482 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.436 HG23 ' H ' ' A' ' 500' ' ' LYS . 15.2 t -68.65 172.12 6.73 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.086 0.47 . . . . 63.32 111.235 -179.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -84.7 18.53 2.33 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.074 -0.512 . . . . 75.45 111.931 -172.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . 0.436 ' H ' HG23 ' A' ' 498' ' ' THR . 13.8 tmtt? -58.09 -32.43 68.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.464 0.649 . . . . 72.11 109.785 174.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.621 ' HD2' HD11 ' A' ' 512' ' ' LEU . 23.0 p90 -144.44 144.11 31.23 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.467 -0.788 . . . . 65.55 109.153 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 22.2 p-90 -147.33 145.44 29.33 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.384 -0.371 . . . . 72.35 110.001 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . 0.639 ' CE2' ' HD3' ' A' ' 495' ' ' ARG . 44.9 p90 -126.87 151.99 47.64 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.327 -0.549 . . . . 63.55 111.651 -178.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.539 ' NZ ' ' HB3' ' A' ' 504' ' ' LYS . 8.9 mtpm? -116.23 150.11 38.07 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.344 -0.844 . . . . 73.34 110.785 179.226 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.496 ' O ' ' HG3' ' A' ' 505' ' ' LYS . 18.5 ptpt -110.62 106.93 16.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.283 0.563 . . . . 74.54 109.804 173.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . 0.584 ' HB2' ' HG3' ' A' ' 509' ' ' ARG . 5.5 m-20 -113.82 80.3 1.36 Allowed 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.23 0.538 . . . . 73.51 109.883 178.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 67.73 -96.7 0.38 Allowed Glycine 0 N--CA 1.449 -0.474 0 CA-C-N 115.579 -0.737 . . . . 52.25 112.495 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.517 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 19.2 pt20 -108.09 -10.83 15.39 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.918 0.39 . . . . 73.34 111.365 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.584 ' HG3' ' HB2' ' A' ' 506' ' ' ASP . 5.2 ptp180 -102.74 136.3 42.81 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.112 0.482 . . . . 74.25 110.528 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 -120.51 122.26 40.24 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.345 -0.613 . . . . 72.21 109.345 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . 0.501 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 12.8 m-70 -109.95 121.64 45.72 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 121.141 -0.223 . . . . 72.2 110.604 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.621 HD11 ' HD2' ' A' ' 501' ' ' TYR . 67.9 tp -106.93 110.62 22.82 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.45 -0.574 . . . . 74.51 109.45 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.413 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.1 mp -100.84 119.85 49.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.238 -0.437 . . . . 75.52 110.145 -178.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.494 ' HB ' ' O ' ' A' ' 471' ' ' VAL . 69.0 mt -106.91 121.27 59.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 N-CA-C 109.395 -0.594 . . . . 74.44 109.395 174.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -64.96 -51.65 60.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.172 -0.467 . . . . 74.03 110.227 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . 0.432 ' O ' ' HE2' ' A' ' 500' ' ' LYS . 42.0 mt-10 -139.39 129.7 25.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.986 -0.552 . . . . 75.44 110.157 178.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.408 ' O ' HG13 ' A' ' 467' ' ' VAL . . . -64.04 132.44 50.57 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.966 -0.383 . . . . 71.11 109.966 175.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 49.7 ttm -128.6 171.85 11.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.926 -0.579 . . . . 60.41 109.625 -174.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 9.4 mp -54.87 -31.77 60.07 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.188 0.44 . . . . 62.23 112.188 -178.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -65.33 -21.45 66.7 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.485 0.55 . . . . 75.44 112.485 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -75.39 -14.56 60.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.888 0.375 . . . . 72.31 110.938 -178.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.431 ' HA ' ' H ' ' A' ' 540' ' ' VAL . . . -64.4 -20.97 66.48 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.2 -0.455 . . . . 50.25 109.935 173.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . 0.437 ' HA3' ' HE3' ' A' ' 488' ' ' LYS . . . -66.06 120.65 16.65 Favored Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 110.825 -0.91 . . . . 51.34 110.825 173.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 17.3 m-70 -64.09 106.93 1.15 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.089 0.471 . . . . 64.33 110.956 -172.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . 0.416 ' HA ' ' O ' ' A' ' 487' ' ' LEU . 96.9 m-85 -75.09 135.03 41.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.416 -0.811 . . . . 73.12 111.459 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.648 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -126.07 139.57 53.29 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.559 -0.746 . . . . 75.15 109.678 175.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 37.5 tp -97.97 107.1 19.51 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.894 -0.409 . . . . 64.11 109.894 179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 53.2 m -91.7 114.01 26.43 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.17 -0.468 . . . . 71.42 110.368 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . . . . . . . . . 3.2 m -119.2 163.4 17.14 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.872 -0.604 . . . . 64.24 109.915 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 26.0 t -72.64 -5.29 36.42 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 111.769 0.285 . . . . 64.44 111.769 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -119.83 -105.7 2.11 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.562 -0.828 . . . . 75.25 111.701 177.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -91.02 124.24 7.47 Favored Glycine 0 N--CA 1.445 -0.705 0 N-CA-C 110.902 -0.879 . . . . 62.32 110.902 174.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.13 141.57 28.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.952 0.406 . . . . 70.44 110.241 -179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -103.62 125.11 49.93 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.115 -0.493 . . . . 74.12 110.365 -178.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 5.2 tt -128.34 121.43 29.15 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.25 0.548 . . . . 74.23 110.294 -177.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -135.0 141.26 46.17 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.458 -0.942 . . . . 74.42 108.458 173.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -96.43 109.7 22.19 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.044 0.926 . . . . 75.34 110.543 -174.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 54.8 tp -95.76 136.75 35.78 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.641 -1.163 . . . . 51.22 109.733 -178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 55.8 mt -126.08 118.87 52.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.992 -0.549 . . . . 72.31 109.649 177.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.431 ' H ' ' HA ' ' A' ' 522' ' ' ALA . 40.9 t -114.44 105.41 18.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 109.699 -0.482 . . . . 65.44 109.699 179.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . 0.432 HE21 HD11 ' A' ' 464' ' ' LEU . 76.5 mt-30 -87.36 139.29 30.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.852 -0.613 . . . . 75.31 110.864 -176.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . 0.41 ' H ' ' CD ' ' A' ' 542' ' ' GLU . 1.0 OUTLIER -86.47 155.99 20.31 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.456 -0.793 . . . . 63.01 110.679 -178.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . 0.401 ' HE3' ' HB3' ' A' ' 543' ' ' LYS . 26.3 mtpp . . . . . 0 C--O 1.248 1.011 0 CA-C-N 115.904 -0.589 . . . . 73.54 109.673 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.81 0 N-CA-C 111.786 -0.526 . . . . 64.31 111.786 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 3.1 p -139.09 141.89 38.13 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.114 -0.328 . . . . 74.22 110.114 177.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 -77.82 92.07 4.19 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.156 0.503 . . . . 70.21 110.311 -178.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 24.3 mmt -116.91 157.34 46.65 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 115.473 -0.785 . . . . 61.43 110.013 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . 0.463 ' O ' HD22 ' A' ' 455' ' ' LEU . 35.1 Cg_exo -62.07 164.36 17.15 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.596 2.198 . . . . 73.52 110.931 172.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 56.5 t -65.98 113.32 2.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.932 -0.307 . . . . 71.4 110.341 -178.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . 0.463 HD22 ' O ' ' A' ' 453' ' ' PRO . 2.6 mm? -78.62 125.22 29.07 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 116.113 -0.494 . . . . 70.23 111.084 -176.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . . . . . . . . . 36.5 mm -81.96 106.34 12.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.064 -0.717 . . . . 64.34 109.064 174.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 86.1 m -62.02 -39.54 92.62 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.105 -0.498 . . . . 74.33 111.491 -175.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -128.63 121.84 21.36 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.445 -0.343 . . . . 64.14 110.532 -179.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.49 167.88 23.64 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.932 2.422 . . . . 70.4 112.398 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . 0.482 ' HB2' ' HB2' ' A' ' 536' ' ' ALA . 97.0 mt -80.89 147.38 30.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.107 -0.497 . . . . 74.44 110.586 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -55.67 122.25 10.96 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.451 -0.795 . . . . 63.44 111.721 179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -93.18 -11.09 33.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.238 -0.892 . . . . 63.4 112.054 -176.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -88.05 157.42 18.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.473 0.654 . . . . 74.11 111.882 -169.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 539' ' ' ILE . 9.0 tt -86.84 142.3 28.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.016 -0.993 . . . . 72.03 110.534 -173.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . . . . . . . . . 27.7 m -130.18 178.17 5.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 CA-C-N 115.936 -0.575 . . . . 72.5 110.823 -178.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . 0.417 ' H ' HE21 ' A' ' 469' ' ' GLN . 21.0 ptp -127.24 160.28 31.78 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.965 0.412 . . . . 75.33 111.531 -178.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.63 146.25 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.188 -0.914 . . . . 62.42 112.45 -176.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 102.02 -7.79 55.2 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 121.084 -0.579 . . . . 45.13 114.136 171.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.417 HE21 ' H ' ' A' ' 466' ' ' MET . 30.2 pt20 -112.51 167.71 10.23 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 122.268 -0.548 . . . . 64.55 110.323 178.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.98 141.34 29.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.976 -0.749 . . . . 65.31 108.976 176.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.731 HG23 ' HB ' ' A' ' 514' ' ' ILE . 6.8 m -127.96 123.38 60.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 121.294 0.569 . . . . 54.01 110.01 176.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -121.93 123.96 42.94 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.303 0.573 . . . . 73.15 110.577 -177.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -114.06 132.67 55.94 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.234 -0.894 . . . . 75.11 109.615 -175.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -120.32 116.91 26.47 Favored 'General case' 0 C--N 1.317 -0.817 0 C-N-CA 120.46 -0.496 . . . . 73.12 110.669 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.666 ' O ' ' HB2' ' A' ' 510' ' ' HIS . 5.9 p -139.26 110.95 7.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.726 -0.67 . . . . 54.41 109.974 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.602 ' HB3' ' H ' ' A' ' 510' ' ' HIS . 0.6 OUTLIER -128.92 163.27 25.66 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.238 -0.437 . . . . 73.44 110.343 -178.644 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.513 HG21 ' HB3' ' A' ' 482' ' ' ALA . 17.7 m -113.67 171.91 3.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.25 -0.432 . . . . 72.21 110.874 -173.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 20.2 t -88.79 -22.28 23.34 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.043 -0.526 . . . . 70.45 110.854 -177.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -96.75 132.51 42.37 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.632 -0.507 . . . . 75.24 109.632 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . 0.651 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 11.4 pt-20 -87.47 137.54 32.25 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.108 0.48 . . . . 74.31 111.012 -175.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 95.58 -6.97 68.15 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.831 -0.699 . . . . 55.3 111.959 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.513 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -77.97 110.71 13.14 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.121 0.486 . . . . 74.3 110.187 178.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -92.8 164.88 13.19 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.822 -0.626 . . . . 62.42 110.508 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.489 HG12 HG23 ' A' ' 529' ' ' THR . 35.5 m -135.95 154.82 34.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.208 -0.451 . . . . 71.31 110.345 -178.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -117.42 138.71 51.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.769 -0.456 . . . . 74.5 109.769 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . 0.587 ' HB2' HD21 ' A' ' 493' ' ' LEU . 87.6 m95 -99.34 138.12 36.87 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.045 0.45 . . . . 72.0 111.217 -176.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' A' ' 526' ' ' ALA . 34.5 tp -121.84 128.99 52.27 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.259 -0.645 . . . . 72.14 109.259 176.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -112.36 106.68 15.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.004 0.431 . . . . 70.02 110.909 -176.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.1 t70 53.63 36.82 24.56 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.447 -0.797 . . . . 73.34 111.625 174.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 94.15 -21.02 44.49 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.771 -0.728 . . . . 62.4 112.669 178.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 61.6 t -99.77 133.07 43.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 110.099 -0.334 . . . . 74.32 110.099 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -78.81 125.61 29.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.868 -0.79 . . . . 63.12 108.868 178.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.587 HD21 ' HB2' ' A' ' 486' ' ' TRP . 3.2 pp -68.73 161.82 27.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.382 0.61 . . . . 71.42 112.098 -170.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 6.6 t -107.4 172.88 6.58 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.126 -0.943 . . . . 52.53 110.903 -172.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -104.64 7.62 35.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.224 0.535 . . . . 75.11 110.274 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -62.11 -69.44 0.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.876 -0.602 . . . . 71.12 111.417 -177.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . 0.538 ' OE2' ' HB2' ' A' ' 500' ' ' LYS . 25.7 tt0 -106.68 118.89 37.85 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.116 0.484 . . . . 72.32 110.477 178.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.605 HG22 ' HB3' ' A' ' 502' ' ' TRP . 3.9 m -111.27 11.69 21.7 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.629 0.728 . . . . 71.43 109.686 175.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . 0.502 ' H ' ' HG2' ' A' ' 497' ' ' GLU . 89.3 m-85 -83.81 -25.51 30.32 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.639 -0.71 . . . . 72.34 111.249 -176.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . 0.538 ' HB2' ' OE2' ' A' ' 497' ' ' GLU . 4.6 ttmp? -69.69 -42.43 74.11 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.113 0.483 . . . . 72.44 110.017 177.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.505 ' HB2' HG12 ' A' ' 514' ' ' ILE . 7.5 p90 -159.0 142.2 14.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.499 -0.773 . . . . 63.34 110.164 -178.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' TRP . . . . . 0.605 ' HB3' HG22 ' A' ' 498' ' ' THR . 0.1 OUTLIER -140.78 145.59 36.55 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 116.201 -0.454 . . . . 74.33 110.991 178.478 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . 0.472 ' HB3' HD13 ' A' ' 512' ' ' LEU . 31.2 p90 -117.77 151.69 36.8 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.21 -0.45 . . . . 74.25 109.925 177.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . . . . . . . . . 1.5 mptp? -115.52 135.44 54.09 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.981 -0.554 . . . . 73.14 109.787 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 1.9 pptp? -104.49 132.71 50.42 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.856 -0.424 . . . . 72.52 109.856 172.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . 0.686 ' HB3' ' HB2' ' A' ' 509' ' ' ARG . 8.0 t70 -143.2 84.38 1.82 Allowed 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.168 -0.469 . . . . 73.31 109.865 -177.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 66.31 -97.61 0.34 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.032 -0.604 . . . . 74.15 111.854 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.651 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 19.1 pt20 -105.55 -7.69 18.46 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.328 0.585 . . . . 73.24 110.315 176.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.686 ' HB2' ' HB3' ' A' ' 506' ' ' ASP . 58.2 mtt180 -84.66 139.87 31.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.415 -0.811 . . . . 73.41 110.807 -175.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . 0.666 ' HB2' ' O ' ' A' ' 475' ' ' CYS . 95.2 m-70 -141.77 116.99 10.07 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.414 -0.587 . . . . 73.14 109.414 174.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 19.8 m-70 -125.75 122.88 37.5 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.93 -0.396 . . . . 75.35 109.93 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 503' ' ' PHE . 54.0 tp -107.39 120.14 41.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.861 0.362 . . . . 54.43 110.513 -176.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . . . . . . . . . 60.5 mt -115.06 114.51 46.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-N 116.504 -0.316 . . . . 52.45 110.556 -178.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.731 ' HB ' HG23 ' A' ' 471' ' ' VAL . 58.5 mt -100.59 119.86 49.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.196 0.522 . . . . 71.2 109.598 176.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -70.75 -37.71 73.44 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.359 -0.837 . . . . 64.45 111.935 -173.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -138.63 111.07 7.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.598 -0.274 . . . . 74.32 111.296 -177.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -67.29 122.35 17.69 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.679 -0.489 . . . . 64.43 109.679 173.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 93.9 mmm -135.04 175.21 9.79 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.886 -0.597 . . . . 74.22 110.548 -174.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.83 -33.76 74.73 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.858 0.361 . . . . 72.4 110.77 177.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -62.85 -26.56 68.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.224 0.535 . . . . 73.23 111.071 173.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -83.2 -14.89 52.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.423 -0.808 . . . . 70.32 110.151 -177.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . . . . . . . . . . . -76.31 5.61 6.79 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.795 -0.638 . . . . 52.21 111.202 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -70.64 158.14 53.61 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.908 -0.663 . . . . 64.21 111.607 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -83.3 114.16 21.21 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 122.048 -0.678 . . . . 72.1 109.999 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -88.37 132.97 34.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.149 0.5 . . . . 61.54 111.503 -174.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.615 ' HB3' ' HB3' ' A' ' 487' ' ' LEU . . . -122.69 142.92 50.16 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.607 -0.724 . . . . 72.03 109.702 175.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.713 ' HB3' ' HB3' ' A' ' 534' ' ' ALA . 10.0 tt -121.13 117.92 28.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.986 0.422 . . . . 44.05 109.999 -176.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 55.9 m -99.23 124.02 43.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.01 -0.541 . . . . 72.21 110.482 -179.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.503 ' HB ' ' H ' ' A' ' 532' ' ' GLY . 2.3 m -113.78 166.13 11.86 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.168 -0.308 . . . . 74.44 110.168 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . . . . . . . . . 9.5 m -54.83 -36.32 64.89 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.807 0.337 . . . . 70.42 111.83 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -136.43 -6.77 1.79 Allowed Glycine 0 C--O 1.227 -0.304 0 C-N-CA 120.476 -0.869 . . . . 74.33 112.716 179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . 0.503 ' H ' ' HB ' ' A' ' 529' ' ' THR . . . -115.34 173.27 14.64 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.828 -0.701 . . . . 52.55 112.266 -179.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -146.68 137.63 24.08 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.917 -0.401 . . . . 72.44 109.917 177.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . 0.713 ' HB3' ' HB3' ' A' ' 527' ' ' LEU . . . -132.65 148.55 52.35 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.405 -0.361 . . . . 62.45 110.501 178.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 7.7 tt -144.62 131.28 20.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.609 -0.886 . . . . 63.52 108.609 178.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . 0.482 ' HB2' ' HB2' ' A' ' 460' ' ' LEU . . . -135.13 137.44 42.77 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.157 0.503 . . . . 51.31 110.757 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -99.68 109.09 21.58 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.994 -0.548 . . . . 75.03 109.846 178.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 52.7 tp -104.23 115.87 31.18 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.731 -0.668 . . . . 54.33 109.792 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.436 ' O ' ' HG ' ' A' ' 464' ' ' LEU . 54.6 mt -105.65 112.37 38.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 109.769 -0.456 . . . . 74.24 109.769 177.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 36.3 t -102.97 102.37 13.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 116.043 -0.526 . . . . 71.51 109.75 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -85.36 145.74 27.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.029 -0.532 . . . . 73.42 111.145 -176.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -81.05 153.77 27.2 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.313 -0.625 . . . . 74.2 109.313 172.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt . . . . . 0 C--O 1.251 1.153 0 CA-C-O 118.337 -0.839 . . . . 53.31 110.085 -178.099 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.684 0 N-CA-C 111.856 -0.498 . . . . 62.11 111.856 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 69.1 m -136.04 148.31 48.3 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.898 0.38 . . . . 74.1 110.958 -179.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 15.7 m170 -68.6 129.79 40.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.92 -0.582 . . . . 65.01 110.504 177.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 20.2 ptp -70.81 152.58 95.09 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.965 -0.562 . . . . 73.34 110.064 177.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.64 150.63 87.88 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.44 2.093 . . . . 52.5 111.701 177.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . . . . . . . . . 46.3 t -66.69 114.72 3.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.199 -0.455 . . . . 63.42 110.275 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 93.4 mt -78.98 142.95 36.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.856 -0.611 . . . . 71.22 110.995 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.414 HD13 HG12 ' A' ' 477' ' ' VAL . 31.0 mm -96.84 119.24 44.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.617 -0.72 . . . . 40.32 109.93 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 31.6 p -92.45 -31.7 15.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.022 0.439 . . . . 74.31 111.597 -178.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.753 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 18.5 mmt180 -101.18 121.63 51.28 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.284 -0.417 . . . . 74.5 110.638 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -86.78 161.27 9.11 Favored 'Trans proline' 0 N--CA 1.45 -1.049 0 C-N-CA 122.077 1.851 . . . . 64.44 112.176 175.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -83.3 172.32 12.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.008 -0.542 . . . . 42.34 110.062 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . 0.868 ' HG3' HD13 ' A' ' 538' ' ' LEU . 4.7 pm0 -56.99 118.21 4.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.818 0.818 . . . . 73.14 112.856 -172.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -95.28 -19.1 20.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.48 -0.782 . . . . 73.33 110.302 172.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -92.16 154.72 18.5 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.805 -0.634 . . . . 75.23 111.605 -174.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.705 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 3.2 tt -90.12 134.86 34.01 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.021 -0.733 . . . . 73.03 109.021 176.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.483 ' N ' HD23 ' A' ' 464' ' ' LEU . 35.8 m -120.8 160.98 21.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.176 0.513 . . . . 73.41 111.778 -174.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . 0.441 ' SD ' ' HD3' ' A' ' 543' ' ' LYS . 23.1 ptp -98.85 153.37 18.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.92 -0.582 . . . . 74.11 110.582 179.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . 0.46 ' CG1' ' HA ' ' A' ' 542' ' ' GLU . 14.3 p -69.01 145.21 13.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.052 -0.522 . . . . 72.25 111.246 177.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 100.5 -24.74 30.92 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.778 -0.725 . . . . 44.21 113.7 172.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.437 HE21 ' HB ' ' A' ' 465' ' ' VAL . 26.5 pt20 -85.81 162.0 18.86 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 117.191 0.496 . . . . 71.01 110.916 -177.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -86.27 116.8 24.68 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.962 -0.563 . . . . 70.43 109.778 176.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 22.0 t -117.23 126.74 74.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 110.037 -0.357 . . . . 52.55 110.037 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.505 ' HG2' HG23 ' A' ' 513' ' ' ILE . 41.2 mt-10 -109.07 123.47 49.22 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.447 -0.342 . . . . 74.03 110.201 -178.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.591 ' CE1' ' HB3' ' A' ' 461' ' ' GLU . 25.3 m-85 -106.85 109.08 20.89 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.415 -0.587 . . . . 71.35 109.415 177.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' A' ' 458' ' ' ARG . 29.5 mt-10 -106.58 116.73 32.44 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.701 -0.481 . . . . 64.23 109.701 -178.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.753 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 36.8 t -135.69 111.81 9.65 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.227 0.537 . . . . 73.52 110.07 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.627 ' HB3' ' H ' ' A' ' 510' ' ' HIS . 7.3 pt-20 -131.05 167.67 18.69 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.776 -0.647 . . . . 72.53 109.897 -176.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.663 HG21 ' HB3' ' A' ' 482' ' ' ALA . 20.9 m -115.06 166.94 8.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-O 120.932 0.396 . . . . 75.13 111.59 -172.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 41.2 t -86.34 -11.08 53.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.73 -0.668 . . . . 73.11 111.695 -176.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -116.22 139.72 50.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.903 0.382 . . . . 71.01 111.208 -175.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . 0.637 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 7.7 tp10 -75.49 146.83 40.29 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.65 -0.705 . . . . 72.1 110.79 -177.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 82.43 -8.76 60.58 Favored Glycine 0 C--N 1.332 0.32 0 CA-C-N 116.018 -0.537 . . . . 73.04 112.977 177.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.663 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -74.72 116.26 15.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.418 0.627 . . . . 71.2 111.484 -176.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -82.31 156.05 24.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.115 -0.948 . . . . 72.12 110.327 178.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 26.8 m -129.27 154.36 40.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.322 -0.399 . . . . 73.41 110.726 -178.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 528' ' ' CYS . 57.3 tttp -118.49 134.93 54.69 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.871 -0.604 . . . . 63.43 110.076 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 99.8 m95 -98.23 122.06 40.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.069 0.461 . . . . 64.32 110.582 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 24.4 tp -120.12 125.35 48.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.654 -0.703 . . . . 64.52 109.53 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.552 ' HD2' HD21 ' A' ' 493' ' ' LEU . 26.1 tttp -101.65 103.65 14.46 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.762 -0.458 . . . . 64.23 109.762 -177.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 1.6 t0 45.81 38.23 4.16 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.781 0.832 . . . . 73.33 112.518 -179.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 93.02 -4.75 75.17 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.542 -0.837 . . . . 54.23 112.711 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 54.3 t -99.85 127.32 52.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 109.947 -0.39 . . . . 54.14 109.947 176.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -72.95 124.56 25.69 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.066 -0.515 . . . . 62.21 110.598 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.552 HD21 ' HD2' ' A' ' 488' ' ' LYS . 86.0 mt -76.49 148.54 37.11 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.135 -0.484 . . . . 63.01 110.787 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . . . . . . . . . 7.8 t -93.48 165.47 12.74 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.901 -0.59 . . . . 73.51 110.771 -177.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -65.61 -29.07 69.61 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.061 0.458 . . . . 73.51 110.677 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -108.77 80.77 1.37 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.3 0.572 . . . . 74.24 110.506 -179.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -96.52 161.32 13.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.354 -0.839 . . . . 73.52 109.888 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . . . . . . . . . 11.2 t -63.29 151.86 39.43 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.058 0.456 . . . . 62.3 110.962 179.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -85.23 16.97 3.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.098 -0.501 . . . . 72.11 111.12 -176.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . 0.7 ' HE3' ' HB2' ' A' ' 516' ' ' GLU . 33.3 tttp -71.66 -28.06 63.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.482 -0.562 . . . . 74.34 109.482 177.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.554 ' HB3' HG23 ' A' ' 514' ' ' ILE . 2.2 p90 -142.82 135.01 27.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.661 -0.7 . . . . 73.31 110.101 173.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' TRP . . . . . 0.488 ' CZ3' ' HE3' ' A' ' 504' ' ' LYS . 11.4 p-90 -139.17 166.51 24.33 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.513 -0.767 . . . . 75.02 109.705 -172.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -133.58 157.46 45.66 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.438 0.637 . . . . 64.25 112.403 -175.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.488 ' HE3' ' CZ3' ' A' ' 502' ' ' TRP . 99.7 mttt -118.21 150.73 38.93 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.549 -1.205 . . . . 73.33 108.913 174.564 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.4 pptp? -137.94 129.87 28.59 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.348 0.594 . . . . 72.34 111.208 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . 0.652 ' HB2' ' HB2' ' A' ' 509' ' ' ARG . 26.9 m-20 -119.56 79.5 1.44 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.58 -0.896 . . . . 50.31 108.58 173.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 60.33 -104.44 0.62 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.92 -0.657 . . . . 74.53 112.402 -175.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.637 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 20.7 pt20 -80.39 -16.38 54.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.995 0.426 . . . . 75.12 110.734 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.652 ' HB2' ' HB2' ' A' ' 506' ' ' ASP . 84.8 mtt180 -84.71 132.02 34.51 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.126 -0.488 . . . . 63.54 110.12 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . 0.627 ' H ' ' HB3' ' A' ' 476' ' ' GLU . 77.9 m-70 -136.14 117.11 14.25 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.38 -0.6 . . . . 72.35 109.38 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . . . . . . . . . 15.6 m-70 -125.63 121.71 34.32 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 121.034 -0.266 . . . . 62.41 110.498 -175.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . 0.409 ' HB3' ' O ' ' A' ' 473' ' ' PHE . 37.7 tp -103.61 133.11 49.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.717 0.294 . . . . 61.33 110.435 -178.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.505 HG23 ' HG2' ' A' ' 472' ' ' GLU . 4.7 mp -121.19 116.85 50.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 110.083 -0.34 . . . . 60.12 110.083 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.554 HG23 ' HB3' ' A' ' 501' ' ' TYR . 46.9 mt -97.49 120.56 46.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.399 -0.593 . . . . 75.41 109.399 175.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -69.06 -41.06 78.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.006 0.432 . . . . 75.15 110.483 -177.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . 0.7 ' HB2' ' HE3' ' A' ' 500' ' ' LYS . 34.2 mt-10 -137.47 107.95 6.52 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.94 -0.573 . . . . 73.42 110.407 -178.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -65.26 122.59 17.46 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.264 -0.643 . . . . 52.23 109.264 174.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . 0.497 ' HG3' ' HG2' ' A' ' 520' ' ' GLU . 11.9 tpt -125.83 157.1 38.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.667 0.27 . . . . 75.43 110.858 -172.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 84.7 mt -60.93 -38.14 84.76 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.231 -0.441 . . . . 73.23 111.397 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . 0.497 ' HG2' ' HG3' ' A' ' 518' ' ' MET . 10.4 pt-20 -70.15 -22.35 62.99 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 121.222 0.534 . . . . 75.3 110.832 178.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -88.09 -13.29 41.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.707 -0.679 . . . . 73.43 110.392 -176.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.524 ' HB2' ' HB ' ' A' ' 540' ' ' VAL . . . -63.0 6.19 0.11 Allowed 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.723 1.009 . . . . 74.24 113.723 -174.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -59.67 137.03 50.01 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.273 -0.731 . . . . 72.15 111.273 175.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -60.94 126.48 27.51 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 110.356 -0.238 . . . . 52.25 110.356 -175.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -84.95 131.15 34.52 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.83 0.824 . . . . 73.25 112.19 -174.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.1 135.79 48.62 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.765 -1.107 . . . . 52.33 109.837 176.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . . . . . . . . . 9.9 tt -122.32 122.99 40.36 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.68 -0.489 . . . . 61.31 109.68 -179.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 485' ' ' LYS . 57.6 m -103.61 124.55 49.02 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.983 -0.553 . . . . 75.52 110.598 -177.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.478 HG21 HG11 ' A' ' 477' ' ' VAL . 14.3 m -117.56 166.59 12.2 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.344 -0.613 . . . . 73.13 109.344 176.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . 0.429 ' N ' HG22 ' A' ' 529' ' ' THR . 22.9 t -66.68 -11.24 53.32 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.82 0.343 . . . . 72.14 110.699 178.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -99.52 -83.6 1.74 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 121.0 -0.619 . . . . 71.44 112.05 177.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -114.02 166.96 12.2 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.7 -0.762 . . . . 63.23 112.24 178.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -109.92 122.71 48.18 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.802 -0.444 . . . . 62.44 109.802 177.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . . . . . . . . . . . -103.2 135.12 45.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.46 -0.336 . . . . 44.24 110.431 179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 8.3 tt -146.05 136.69 24.18 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.892 -0.41 . . . . 63.23 109.892 -178.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -143.5 155.27 44.29 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.278 -0.419 . . . . 72.44 109.945 178.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -96.54 112.06 23.95 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.4 0.619 . . . . 64.43 111.225 -177.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.868 HD13 ' HG3' ' A' ' 461' ' ' GLU . 62.8 tp -94.52 136.45 34.81 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.668 -0.697 . . . . 64.2 110.115 177.132 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.705 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 65.3 mt -133.15 134.03 57.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 108.848 -0.797 . . . . 75.01 108.848 175.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.524 ' HB ' ' HB2' ' A' ' 522' ' ' ALA . 98.4 t -122.84 116.28 48.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 110.021 -0.362 . . . . 70.21 110.021 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . 0.635 ' HG3' HD21 ' A' ' 464' ' ' LEU . 43.7 mt-30 -94.34 140.58 29.62 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.25 -0.432 . . . . 74.2 110.758 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . 0.46 ' HA ' ' CG1' ' A' ' 467' ' ' VAL . 41.9 tt0 -75.0 141.26 43.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.534 -0.757 . . . . 64.21 109.541 175.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . 0.441 ' HD3' ' SD ' ' A' ' 466' ' ' MET . 54.4 mtmt . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.13 -0.938 . . . . 74.22 109.512 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 112.416 -0.274 . . . . 53.32 112.416 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' SER . . . . . . . . . . . . . 31.3 m -73.17 129.5 38.19 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.856 0.36 . . . . 50.42 111.388 -177.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -108.95 178.54 4.44 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.068 -0.715 . . . . 73.43 109.068 172.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' MET . . . . . . . . . . . . . 57.2 mtm -113.94 99.07 49.6 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-O 120.903 0.382 . . . . 71.33 110.628 179.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -72.23 135.76 25.45 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.073 1.849 . . . . 73.23 111.424 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' VAL . . . . . 0.438 HG12 ' HB ' ' A' ' 477' ' ' VAL . 19.6 t -74.9 111.26 10.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 109.59 -0.522 . . . . 72.02 109.59 178.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' LEU . . . . . . . . . . . . . 90.6 mt -97.6 164.06 12.58 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.924 -0.58 . . . . 73.22 110.901 -175.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' ILE . . . . . 0.473 HD13 HG12 ' A' ' 477' ' ' VAL . 48.4 mm -96.87 115.06 35.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.838 -0.619 . . . . 63.45 110.193 -178.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' THR . . . . . . . . . . . . . 33.7 m -85.69 -35.61 20.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.145 0.498 . . . . 65.41 110.823 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' ARG . . . . . 0.839 ' HB2' ' HA ' ' A' ' 475' ' ' CYS . 5.7 mmp_? -108.52 108.14 60.71 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.094 -0.503 . . . . 71.14 110.362 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_exo -70.78 155.63 62.21 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.405 2.07 . . . . 72.2 111.436 176.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.11 162.7 23.59 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.774 -0.454 . . . . 74.2 109.774 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -69.91 121.04 16.56 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.487 0.661 . . . . 61.4 111.444 -173.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -92.22 -11.65 34.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.993 -1.003 . . . . 73.51 111.711 -176.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -87.56 156.01 19.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.127 0.489 . . . . 71.34 110.925 -170.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.659 ' HG ' ' HB ' ' A' ' 539' ' ' ILE . 6.0 tt -88.55 136.61 32.9 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.363 -0.835 . . . . 74.15 109.679 -171.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' VAL . . . . . 0.49 ' N ' HD23 ' A' ' 464' ' ' LEU . 30.6 m -120.97 172.25 8.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.269 0.557 . . . . 70.24 111.655 -173.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' MET . . . . . 0.621 ' H ' ' NE2' ' A' ' 469' ' ' GLN . 66.5 mtt -116.62 163.52 15.98 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.795 -0.639 . . . . 64.31 109.964 178.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' VAL . . . . . 0.5 ' HA ' ' O ' ' A' ' 517' ' ' ALA . 48.6 t -65.04 131.02 30.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.338 -0.392 . . . . 72.12 111.185 179.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' GLY . . . . . . . . . . . . . . . 101.14 -14.32 58.43 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.818 -0.706 . . . . 74.51 114.602 171.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.621 ' NE2' ' H ' ' A' ' 466' ' ' MET . 9.6 pt20 -83.17 149.42 26.86 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.923 0.862 . . . . 64.14 110.637 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' ARG . . . . . . . . . . . . . 44.8 ttt180 -73.6 116.1 13.78 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.524 -0.762 . . . . 71.21 110.567 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 95.0 t -120.86 123.38 70.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.792 -0.64 . . . . 71.43 109.859 179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -133.92 140.79 47.02 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.185 0.517 . . . . 74.52 110.172 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.544 ' HZ ' HD22 ' A' ' 538' ' ' LEU . 90.5 m-85 -105.99 124.8 50.15 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.854 -0.612 . . . . 71.52 110.786 -175.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -97.63 117.73 32.57 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 107.969 -1.123 . . . . 74.13 107.969 176.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' CYS . . . . . 0.839 ' HA ' ' HB2' ' A' ' 458' ' ' ARG . 6.4 p -140.23 119.04 12.47 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.184 0.516 . . . . 73.1 111.699 -175.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.599 ' HG2' ' CG ' ' A' ' 458' ' ' ARG . 10.1 pt-20 -131.05 148.81 52.79 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.005 -0.739 . . . . 73.24 109.005 175.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 482' ' ' ALA . 18.3 m -111.19 164.38 7.17 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 116.238 -0.437 . . . . 73.13 110.859 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' SER . . . . . . . . . . . . . 53.5 p -65.67 -25.89 67.54 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.032 -0.531 . . . . 71.11 112.403 -174.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -106.87 133.7 51.13 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.912 -0.315 . . . . 70.34 110.786 -174.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' GLU . . . . . 0.665 ' HA ' ' HB3' ' A' ' 508' ' ' GLN . 10.0 tp10 -73.36 147.4 44.39 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.086 -0.506 . . . . 74.43 110.673 -178.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 61.27 34.45 88.2 Favored Glycine 0 N--CA 1.453 -0.221 0 CA-C-N 115.898 -0.592 . . . . 53.52 112.82 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.49 ' HB3' HG21 ' A' ' 477' ' ' VAL . . . -95.19 154.45 17.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.006 0.432 . . . . 62.31 111.062 -178.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -100.77 133.11 45.72 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.75 -0.659 . . . . 73.02 110.647 -179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . 0.519 ' HB ' HD21 ' A' ' 527' ' ' LEU . 32.5 m -124.15 144.24 34.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.931 -0.577 . . . . 70.33 109.547 175.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' LYS . . . . . . . . . . . . . 28.2 ttpp -126.96 141.04 51.9 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.751 0.31 . . . . 65.14 110.292 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -98.3 137.35 37.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.086 -0.507 . . . . 73.44 111.074 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' LEU . . . . . . . . . . . . . 55.6 tp -134.21 118.78 18.0 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.747 -0.835 . . . . 74.35 108.747 173.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' LYS . . . . . 0.455 ' HD3' ' C ' ' A' ' 488' ' ' LYS . 14.1 tmtt? -109.52 106.2 15.83 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.703 -0.399 . . . . 64.22 110.518 -176.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 2.5 t70 48.66 38.74 12.08 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.333 -0.849 . . . . 72.4 112.015 173.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' GLY . . . . . . . . . . . . . . . 98.62 -16.01 60.26 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 120.79 -0.719 . . . . 73.01 113.001 178.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 47.4 t -104.72 122.23 57.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.741 0.305 . . . . 72.11 110.427 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -81.46 133.94 35.47 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.765 -0.457 . . . . 62.02 109.765 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 69.4 mt -74.99 152.89 38.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.104 -0.498 . . . . 65.33 111.114 -175.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' THR . . . . . 0.685 HG22 ' H ' ' A' ' 496' ' ' GLU . 4.8 m -91.2 141.51 28.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.029 -0.532 . . . . 63.31 110.937 -175.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 40.8 ptt180 -83.13 -6.2 59.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.23 0.538 . . . . 74.23 110.539 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' GLU . . . . . 0.685 ' H ' HG22 ' A' ' 494' ' ' THR . 7.6 pt-20 -130.35 34.72 4.15 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.554 -0.748 . . . . 73.2 109.763 178.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' GLU . . . . . 0.569 ' HB2' ' HB ' ' A' ' 494' ' ' THR . 7.1 tp10 -71.93 170.71 13.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.315 -0.857 . . . . 71.42 110.782 -176.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' THR . . . . . 0.473 HG23 ' H ' ' A' ' 500' ' ' LYS . 8.9 t -68.58 -176.7 0.83 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 116.119 -0.491 . . . . 74.22 110.837 175.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.8 p90 -78.99 17.1 0.79 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.456 -0.338 . . . . 71.12 111.853 -174.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' LYS . . . . . 0.473 ' H ' HG23 ' A' ' 498' ' ' THR . 21.6 tptm -61.87 -45.96 91.48 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.908 -0.775 . . . . 74.44 108.908 176.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' TYR . . . . . 0.558 ' HB3' HG12 ' A' ' 514' ' ' ILE . 10.1 p90 -143.04 143.39 31.86 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.054 -0.976 . . . . 73.24 109.52 176.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' TRP . . . . . . . . . . . . . 35.9 p-90 -135.91 145.34 46.18 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.865 -0.42 . . . . 71.52 109.865 176.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' PHE . . . . . 0.478 ' HA ' ' O ' ' A' ' 511' ' ' HIS . 44.6 p90 -114.86 140.9 48.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.592 0.711 . . . . 64.13 111.818 -175.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' LYS . . . . . 0.463 ' HB3' ' HB2' ' A' ' 511' ' ' HIS . 24.1 tptm -116.31 114.18 23.99 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.802 -1.09 . . . . 74.31 109.137 176.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.482 ' O ' ' HD3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -112.37 138.37 49.2 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.06 0.457 . . . . 72.51 112.192 -176.169 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -149.59 85.41 1.44 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.836 -0.62 . . . . 62.15 109.855 170.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . 69.5 -116.68 7.18 Favored Glycine 0 N--CA 1.449 -0.492 0 CA-C-N 115.614 -0.721 . . . . 61.25 112.777 179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' GLN . . . . . 0.665 ' HB3' ' HA ' ' A' ' 480' ' ' GLU . 4.1 pt20 -76.98 -25.95 53.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.708 0.29 . . . . 74.13 111.508 -177.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 509' ' ' ARG . 3.9 ptt180 -99.12 127.0 44.99 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.374 0.606 . . . . 71.14 111.448 -174.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -129.39 155.96 44.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.477 -0.783 . . . . 70.44 109.705 -178.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' HIS . . . . . 0.478 ' O ' ' HA ' ' A' ' 503' ' ' PHE . 80.4 m-70 -138.9 124.58 19.62 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.897 -0.408 . . . . 73.23 109.897 -179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' LEU . . . . . . . . . . . . . 56.9 tp -111.46 106.09 14.89 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.929 -0.397 . . . . 62.42 109.929 176.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' ILE . . . . . 0.407 ' N ' HD12 ' A' ' 513' ' ' ILE . 4.5 mp -103.25 118.41 50.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 121.06 0.457 . . . . 71.31 111.018 -176.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' ILE . . . . . 0.558 HG12 ' HB3' ' A' ' 501' ' ' TYR . 62.2 mt -101.9 121.76 53.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.145 -0.687 . . . . 74.25 109.145 174.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -64.14 -51.41 64.03 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.267 -0.424 . . . . 54.35 111.396 -174.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -133.01 114.87 14.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.342 -0.39 . . . . 73.2 110.151 175.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.5 ' O ' ' HA ' ' A' ' 467' ' ' VAL . . . -62.69 127.53 31.7 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.695 -0.483 . . . . 75.12 109.695 173.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' MET . . . . . . . . . . . . . 28.6 ttm -132.58 173.68 11.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.976 -0.379 . . . . 74.31 109.976 -174.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.428 ' H ' HD22 ' A' ' 519' ' ' LEU . 3.4 mm? -53.43 -36.63 61.76 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.606 0.595 . . . . 74.01 112.606 -172.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' GLU . . . . . 0.486 ' CD ' ' H ' ' A' ' 520' ' ' GLU . 1.8 mp0 -58.92 -35.02 72.38 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.948 0.404 . . . . 74.14 110.895 -178.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -74.43 -13.52 60.72 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.995 -0.548 . . . . 73.43 112.223 -169.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' ALA . . . . . 0.588 ' HA ' ' O ' ' A' ' 538' ' ' LEU . . . -63.78 7.33 0.12 Allowed 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 113.911 1.078 . . . . 72.33 113.911 -175.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' GLY . . . . . . . . . . . . . . . -86.63 169.3 40.82 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.987 -0.625 . . . . 72.14 112.443 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -73.97 119.84 18.74 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 122.717 -0.284 . . . . 74.51 110.804 -178.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 525' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -86.43 135.0 33.66 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.765 0.317 . . . . 72.2 110.804 178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -130.4 134.63 47.28 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.062 0.458 . . . . 44.53 110.475 175.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 527' ' ' LEU . . . . . 0.519 HD21 ' HB ' ' A' ' 484' ' ' VAL . 7.5 tt -118.04 111.85 19.46 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.053 -0.721 . . . . 71.43 109.053 177.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 528' ' ' CYS . . . . . . . . . . . . . 43.9 t -99.24 128.1 45.32 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.926 0.393 . . . . 62.41 110.593 -177.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 529' ' ' THR . . . . . 0.529 HG22 ' H ' ' A' ' 530' ' ' SER . 1.8 m -117.88 175.47 5.65 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.892 -0.594 . . . . 75.33 109.45 176.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 530' ' ' SER . . . . . 0.529 ' H ' HG22 ' A' ' 529' ' ' THR . 9.1 m -58.52 -24.36 60.38 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.014 0.375 . . . . 42.12 112.014 178.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 531' ' ' GLY . . . . . . . . . . . . . . . -112.28 -88.38 1.76 Allowed Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.637 -0.792 . . . . 73.35 112.21 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -94.18 -172.25 38.58 Favored Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.819 -0.705 . . . . 43.22 112.016 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -145.49 147.55 32.29 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.005 0.431 . . . . 74.02 110.725 179.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' ALA . . . . . 0.433 ' HB2' HG21 ' A' ' 456' ' ' ILE . . . -105.75 118.71 37.3 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.007 -0.542 . . . . 75.33 110.115 178.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 7.5 tt -114.99 124.72 52.4 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 109.441 -0.577 . . . . 74.23 109.441 179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' ALA . . . . . . . . . . . . . . . -148.36 149.11 31.2 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.985 -0.552 . . . . 61.43 109.809 178.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -116.77 112.92 21.83 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.372 0.606 . . . . 72.23 111.052 -177.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.588 ' O ' ' HA ' ' A' ' 522' ' ' ALA . 31.3 tp -96.92 111.5 23.68 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.298 -0.864 . . . . 73.15 109.462 -179.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' ILE . . . . . 0.659 ' HB ' ' HG ' ' A' ' 464' ' ' LEU . 63.3 mt -97.47 129.11 48.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 110.129 -0.323 . . . . 63.34 110.129 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 34.7 t -111.54 116.47 52.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 116.13 -0.486 . . . . 61.42 110.601 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . 0.565 ' HG3' HD21 ' A' ' 464' ' ' LEU . 98.4 mt-30 -99.61 155.44 17.6 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.085 0.469 . . . . 75.34 111.173 179.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -80.56 149.75 29.82 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.615 -0.721 . . . . 74.22 110.654 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' LYS . . . . . . . . . . . . . 49.7 mtmt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.723 -0.656 . . . . 73.42 110.157 -179.756 . . . . . . . . 0 0 . 1 stop_ save_