data_2jy5_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 2jy5 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 546' ' ' ARG . . . . . 0.631 ' HA ' ' HB2' ' A' ' 566' ' ' LEU . 5.8 mtm180 . . . . . 0 N--CA 1.436 -1.168 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 547' ' ' PHE . . . . . 0.621 ' N ' HD13 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 63.99 18.23 11.08 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 -177.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 548' ' ' GLN . . . . . 0.443 ' HA ' HD23 ' A' ' 551' ' ' LEU . 1.8 mt-30 29.89 -78.7 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 113.773 -1.558 . . . . 0.0 114.133 177.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 549' ' ' GLN . . . . . 0.548 ' O ' ' HB3' ' A' ' 552' ' ' GLU . 15.0 mm100 -71.4 -50.82 28.15 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.425 -177.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 550' ' ' GLN . . . . . 0.761 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 4.1 mm100 -52.09 -40.67 61.58 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.088 -0.96 . . . . 0.0 108.874 178.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 551' ' ' LEU . . . . . 0.526 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -62.63 -40.74 97.96 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.724 177.706 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . 0.548 ' HB3' ' O ' ' A' ' 549' ' ' GLN . 5.1 tp10 -53.59 -32.12 49.73 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.55 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 553' ' ' GLN . . . . . 0.473 ' NE2' ' HA ' ' A' ' 550' ' ' GLN . 0.4 OUTLIER -77.39 -58.46 3.26 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 118.826 -0.607 . . . . 0.0 112.614 179.611 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . 0.637 HD11 HD23 ' A' ' 583' ' ' LEU . 10.9 mt -57.85 -32.43 67.63 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 120.43 1.468 . . . . 0.0 110.369 178.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 44.9 t -68.9 -40.16 79.3 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -55.35 -27.17 45.51 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.503 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 557' ' ' MET . . . . . 0.532 ' HG3' HD11 ' A' ' 580' ' ' ILE . 26.5 mmm -89.31 24.98 2.03 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.898 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 75.56 39.94 33.68 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 115.416 0.926 . . . . 0.0 115.416 178.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 559' ' ' PHE . . . . . 0.495 ' HB2' ' O ' ' A' ' 554' ' ' LEU . 10.3 m-85 -104.44 126.89 51.95 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 118.189 0.995 . . . . 0.0 110.662 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 87.9 mt -96.31 -18.85 19.69 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -77.18 82.2 3.67 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 562' ' ' ARG . . . . . 0.585 ' HA ' ' ND2' ' A' ' 565' ' ' ASN . 15.6 mmt180 -59.89 -53.54 56.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.791 -177.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -52.33 -31.85 35.2 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.457 0.646 . . . . 0.0 110.794 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -73.47 -23.24 60.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.012 -178.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . 0.585 ' ND2' ' HA ' ' A' ' 562' ' ' ARG . 14.8 m-20 -78.65 -47.8 16.32 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.631 ' HB2' ' HA ' ' A' ' 546' ' ' ARG . 0.6 OUTLIER -52.48 -47.92 66.23 Favored 'General case' 0 N--CA 1.42 -1.926 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.772 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -72.34 -38.12 68.69 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.981 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 568' ' ' ALA . . . . . 0.495 ' HB3' ' HB1' ' A' ' 579' ' ' ALA . . . -60.39 -31.89 70.79 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 118.93 -1.108 . . . . 0.0 108.424 178.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . 0.761 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 4.0 mm? -73.84 -37.43 64.82 Favored 'General case' 0 N--CA 1.428 -1.561 0 CA-C-O 120.893 0.377 . . . . 0.0 111.818 -178.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 22.7 mm -65.43 -38.6 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.778 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -81.13 -15.53 55.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.394 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 572' ' ' THR . . . . . 0.463 HG21 ' HB3' ' A' ' 579' ' ' ALA . 39.6 p -104.86 4.59 32.23 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 47.4 32.01 7.05 Favored Glycine 0 C--N 1.337 0.585 0 N-CA-C 115.027 0.771 . . . . 0.0 115.027 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 574' ' ' GLY . . . . . 0.425 ' HA2' ' NE2' ' A' ' 550' ' ' GLN . . . 108.1 -17.46 34.85 Favored Glycine 0 C--O 1.229 -0.178 0 C-N-CA 120.078 -1.058 . . . . 0.0 113.212 179.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 575' ' ' ASP . . . . . 0.44 ' HB3' ' HB3' ' A' ' 578' ' ' ALA . 3.3 m-20 -75.27 78.82 2.37 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.657 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -67.54 -33.86 64.77 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.976 -177.079 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 577' ' ' ASN . . . . . 0.592 ' HA ' HG13 ' A' ' 580' ' ' ILE . 1.0 OUTLIER -66.29 -46.68 76.15 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 124.334 1.021 . . . . 0.0 108.697 179.872 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 578' ' ' ALA . . . . . 0.44 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -62.55 -31.04 71.76 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.981 -1.463 . . . . 0.0 107.742 177.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 579' ' ' ALA . . . . . 0.495 ' HB1' ' HB3' ' A' ' 568' ' ' ALA . . . -74.26 -33.9 63.44 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.271 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 580' ' ' ILE . . . . . 0.657 HG13 ' O ' ' A' ' 576' ' ' ILE . 3.7 mt -62.78 -44.02 99.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 121.444 0.64 . . . . 0.0 110.431 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . 0.427 ' HA ' HD22 ' A' ' 584' ' ' LEU . 39.7 mt-10 -68.94 -39.17 79.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.711 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 582' ' ' ARG . . . . . . . . . . . . . 2.2 ttt85 -77.44 -40.8 42.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.406 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 583' ' ' LEU . . . . . 0.637 HD23 HD11 ' A' ' 554' ' ' LEU . 8.2 tp -62.52 -44.58 96.01 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.624 -177.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 584' ' ' LEU . . . . . 0.431 ' O ' HD13 ' A' ' 584' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.42 -1.972 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 546' ' ' ARG . . . . . 0.578 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 6.3 mtm180 . . . . . 0 N--CA 1.439 -0.98 0 CA-C-O 120.96 0.41 . . . . 0.0 110.284 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 547' ' ' PHE . . . . . 0.542 ' N ' HD11 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 59.34 22.6 10.99 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 -178.13 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 548' ' ' GLN . . . . . 0.698 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.9 pt20 29.42 -79.16 0.0 OUTLIER 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.516 1.527 . . . . 0.0 114.325 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 549' ' ' GLN . . . . . 0.698 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 24.6 mt-30 -71.7 -49.84 35.79 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.752 0.787 . . . . 0.0 111.006 -177.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 550' ' ' GLN . . . . . 0.605 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 11.2 mp0 -52.28 -40.33 61.63 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.345 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 551' ' ' LEU . . . . . 0.578 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -60.22 -40.23 89.43 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.749 176.684 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . 0.51 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 42.1 mt-10 -53.33 -32.35 48.62 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.752 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 553' ' ' GLN . . . . . 0.434 ' CD ' HD13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -78.29 -59.02 2.95 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 118.925 -0.56 . . . . 0.0 112.057 179.667 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . 0.636 HD23 HG12 ' A' ' 580' ' ' ILE . 8.1 mt -54.28 -33.02 57.75 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 120.092 1.315 . . . . 0.0 110.992 177.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 48.4 t -69.91 -39.8 75.99 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.35 -33.46 59.09 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 43.1 mmm -97.58 22.09 9.42 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.177 0.898 . . . . 0.0 111.077 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . 0.413 ' O ' ' O ' ' A' ' 559' ' ' PHE . . . 117.14 -118.85 4.26 Favored Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 559' ' ' PHE . . . . . 0.433 ' HD1' HD22 ' A' ' 561' ' ' ASN . 90.4 m-85 29.85 112.01 0.0 OUTLIER 'General case' 0 C--O 1.232 0.139 0 N-CA-C 116.018 1.859 . . . . 0.0 116.018 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 68.3 mt -107.83 8.92 28.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.533 178.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . 0.463 ' HB2' ' HB3' ' A' ' 564' ' ' ALA . 0.3 OUTLIER -87.9 105.75 17.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.136 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 562' ' ' ARG . . . . . 0.56 ' HB3' ' HD3' ' A' ' 546' ' ' ARG . 24.2 mmt180 -59.6 -68.75 0.25 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.555 -178.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -32.11 31.15 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.217 -179.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 564' ' ' ALA . . . . . 0.463 ' HB3' ' HB2' ' A' ' 561' ' ' ASN . . . -76.76 -24.72 52.96 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -177.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . 0.604 ' O ' HD22 ' A' ' 569' ' ' LEU . 86.1 m-20 -78.68 -49.84 12.45 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 120.816 0.341 . . . . 0.0 110.61 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.542 HD11 ' N ' ' A' ' 547' ' ' PHE . 1.1 tp -57.31 -45.77 83.88 Favored 'General case' 0 N--CA 1.421 -1.883 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.139 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -71.94 -40.22 68.88 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 568' ' ' ALA . . . . . 0.499 ' HB1' HD13 ' A' ' 554' ' ' LEU . . . -57.29 -30.32 64.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.21 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . 0.639 HD12 HD12 ' A' ' 576' ' ' ILE . 3.3 mm? -72.68 -34.93 67.54 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.496 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 39.1 mm -73.86 -42.1 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-O 121.474 0.654 . . . . 0.0 109.246 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -57.62 -29.21 64.34 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.726 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 32.0 p -99.37 -38.73 8.72 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.766 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 93.88 27.47 12.53 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.891 -0.671 . . . . 0.0 113.227 177.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 126.28 -33.04 3.58 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.49 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.8 79.64 1.13 Allowed 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.639 HD12 HD12 ' A' ' 569' ' ' LEU . 0.3 OUTLIER -64.83 -36.09 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.927 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.12 -176.819 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 577' ' ' ASN . . . . . 0.611 ' HA ' HG13 ' A' ' 580' ' ' ILE . 1.0 OUTLIER -65.22 -40.2 93.8 Favored 'General case' 0 N--CA 1.442 -0.834 0 O-C-N 124.324 1.015 . . . . 0.0 108.501 179.223 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -66.59 -33.26 75.28 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.027 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 579' ' ' ALA . . . . . 0.493 ' HA ' ' HG2' ' A' ' 582' ' ' ARG . . . -73.51 -33.64 64.87 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.855 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 580' ' ' ILE . . . . . 0.636 HG12 HD23 ' A' ' 554' ' ' LEU . 2.8 mt -61.62 -48.67 87.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 121.494 0.664 . . . . 0.0 110.599 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . 0.503 ' HA ' HD21 ' A' ' 584' ' ' LEU . 37.4 tt0 -67.67 -36.83 81.44 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.895 -178.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 582' ' ' ARG . . . . . 0.633 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -77.87 -38.98 44.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.183 0.516 . . . . 0.0 110.647 -179.199 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 583' ' ' LEU . . . . . 0.633 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 11.2 tp -63.91 -40.41 96.43 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 123.674 0.79 . . . . 0.0 110.878 -178.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 584' ' ' LEU . . . . . 0.503 HD21 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.419 -2.021 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 546' ' ' ARG . . . . . 0.775 HH11 ' HG3' ' A' ' 546' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.421 -1.921 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 547' ' ' PHE . . . . . 0.527 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.08 28.69 10.25 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 119.322 -0.951 . . . . 0.0 109.713 178.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 548' ' ' GLN . . . . . 0.674 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 6.5 pt20 28.16 -81.6 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 125.004 1.322 . . . . 0.0 114.228 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 549' ' ' GLN . . . . . 0.674 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 3.7 pt20 -73.34 -50.07 23.95 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.334 -178.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 550' ' ' GLN . . . . . 0.666 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 11.9 mp0 -50.11 -36.26 29.01 Favored 'General case' 0 C--O 1.245 0.843 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 177.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 551' ' ' LEU . . . . . 0.717 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -62.68 -45.15 94.13 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 114.137 -1.392 . . . . 0.0 109.928 177.0 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . 0.57 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 14.6 mm-40 -52.87 -32.09 42.97 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.362 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 553' ' ' GLN . . . . . 0.598 ' HG3' HD13 ' A' ' 576' ' ' ILE . 8.5 mm-40 -73.61 -60.24 2.34 Favored 'General case' 0 C--O 1.246 0.894 0 N-CA-C 112.424 0.528 . . . . 0.0 112.424 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . 0.805 HD12 HD23 ' A' ' 583' ' ' LEU . 11.6 mt -62.91 -29.86 71.1 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.535 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 555' ' ' SER . . . . . 0.543 ' HB2' HD11 ' A' ' 551' ' ' LEU . 46.7 t -69.73 -38.47 76.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -55.91 -26.58 48.21 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.434 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 557' ' ' MET . . . . . 0.537 ' HG3' HD13 ' A' ' 580' ' ' ILE . 84.8 mmm -87.34 25.32 1.42 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.317 0.58 . . . . 0.0 110.138 178.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 44.31 44.15 7.73 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-N 114.728 -1.124 . . . . 0.0 113.633 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 559' ' ' PHE . . . . . 0.466 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 1.6 m-85 -76.11 -41.96 48.6 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 113.353 0.872 . . . . 0.0 113.353 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 23.4 mt 66.28 7.15 4.68 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 178.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . 0.424 ' C ' HD21 ' A' ' 561' ' ' ASN . 0.2 OUTLIER -108.98 79.56 1.23 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 179.398 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 562' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -58.65 -29.07 66.26 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.59 -178.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -65.16 -51.84 58.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.075 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.81 -25.1 44.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.253 -178.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . 0.747 HD21 ' NH1' ' A' ' 546' ' ' ARG . 90.0 m-20 -60.8 -58.02 10.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.781 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.555 HD13 ' HA ' ' A' ' 546' ' ' ARG . 2.1 tp -63.82 -30.95 71.99 Favored 'General case' 0 N--CA 1.424 -1.751 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -69.9 -32.01 70.1 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.385 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 568' ' ' ALA . . . . . 0.57 ' HB3' ' HB1' ' A' ' 579' ' ' ALA . . . -77.36 -38.91 49.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.859 0.362 . . . . 0.0 110.768 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . 0.666 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.9 mm? -64.05 -49.56 71.87 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.224 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 83.4 mt -70.07 -39.74 77.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.259 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -67.96 -15.33 63.56 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 48.7 p -108.13 -40.89 5.07 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 119.756 -0.778 . . . . 0.0 110.324 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 94.42 43.45 3.71 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.378 -0.915 . . . . 0.0 112.652 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 110.84 -33.42 5.91 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.343 -0.932 . . . . 0.0 112.271 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.96 87.51 1.33 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.598 HD13 ' HG3' ' A' ' 553' ' ' GLN . 0.6 OUTLIER -77.62 -27.0 15.28 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.425 -176.836 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 577' ' ' ASN . . . . . 0.695 ' HA ' HG13 ' A' ' 580' ' ' ILE . 0.9 OUTLIER -68.84 -53.64 20.27 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.867 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -58.44 -29.87 66.49 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.249 -1.341 . . . . 0.0 107.76 176.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 579' ' ' ALA . . . . . 0.57 ' HB1' ' HB3' ' A' ' 568' ' ' ALA . . . -74.82 -27.44 60.29 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.12 -1.4 . . . . 0.0 110.929 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 580' ' ' ILE . . . . . 0.695 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.3 mt -69.51 -43.42 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 121.081 0.467 . . . . 0.0 110.604 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . 0.64 ' HA ' HD23 ' A' ' 584' ' ' LEU . 41.6 tt0 -69.49 -38.02 77.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.217 -178.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 582' ' ' ARG . . . . . 0.665 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -75.41 -32.12 60.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.497 -179.335 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 583' ' ' LEU . . . . . 0.805 HD23 HD12 ' A' ' 554' ' ' LEU . 8.1 tp -72.14 -31.89 66.41 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.79 -178.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 584' ' ' LEU . . . . . 0.64 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.408 -2.531 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 546' ' ' ARG . . . . . 0.598 ' HE ' HD21 ' A' ' 551' ' ' LEU . 2.2 ptt180 . . . . . 0 CA--C 1.513 -0.446 0 CA-C-O 121.79 0.805 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 547' ' ' PHE . . . . . 0.546 ' O ' ' N ' ' A' ' 549' ' ' GLN . 0.1 OUTLIER 60.38 18.63 8.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.043 179.02 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 548' ' ' GLN . . . . . 0.69 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.8 pt20 28.29 -76.17 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 177.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 549' ' ' GLN . . . . . 0.69 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 12.4 mm100 -72.21 -50.81 24.59 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.559 0.695 . . . . 0.0 110.897 -178.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 550' ' ' GLN . . . . . 0.535 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 10.9 mp0 -53.93 -42.18 68.54 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 551' ' ' LEU . . . . . 0.598 HD21 ' HE ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -56.5 -40.84 75.65 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.24 176.167 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . 0.582 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 14.3 tt0 -55.4 -32.54 62.73 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.443 -179.091 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 553' ' ' GLN . . . . . 0.495 ' HB3' HG22 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -74.28 -58.18 3.46 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.293 179.347 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . 0.557 HD12 HD22 ' A' ' 569' ' ' LEU . 7.9 mt -55.81 -29.85 60.41 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.485 177.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 44.0 t -70.26 -39.36 75.04 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.26 -35.14 62.2 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.467 -0.788 . . . . 0.0 113.084 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 557' ' ' MET . . . . . 0.401 ' SD ' HD13 ' A' ' 580' ' ' ILE . 10.8 mtp -97.97 21.37 10.76 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.006 0.821 . . . . 0.0 110.801 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 119.53 -118.49 3.96 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.751 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 28.39 108.35 0.0 OUTLIER 'General case' 0 C--O 1.232 0.17 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.5 12.38 29.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 113.91 -1.495 . . . . 0.0 108.86 178.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -97.78 109.34 22.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.684 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 562' ' ' ARG . . . . . 0.592 ' HB3' ' HD2' ' A' ' 546' ' ' ARG . 27.0 mmt180 -59.33 -61.8 2.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.158 -178.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -35.52 64.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.214 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -77.58 -25.73 50.2 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -177.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . 0.533 ' O ' HD22 ' A' ' 569' ' ' LEU . 78.0 m-20 -71.53 -55.62 7.48 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.441 -0.504 . . . . 0.0 109.929 -179.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.544 HD23 ' HD2' ' A' ' 547' ' ' PHE . 0.3 OUTLIER -55.98 -46.0 78.78 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.248 -179.567 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 567' ' ' GLN . . . . . 0.57 HE21 ' HA ' ' A' ' 567' ' ' GLN . 0.0 OUTLIER -61.21 -42.21 98.19 Favored 'General case' 0 CA--C 1.504 -0.826 0 C-N-CA 119.359 -0.936 . . . . 0.0 112.93 -178.209 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 568' ' ' ALA . . . . . 0.606 ' HB2' ' HB2' ' A' ' 579' ' ' ALA . . . -62.12 -28.41 69.62 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 118.857 -1.137 . . . . 0.0 108.295 177.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . 0.57 HD13 HD11 ' A' ' 576' ' ' ILE . 3.0 mm? -73.11 -42.97 62.36 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 41.5 mm -72.55 -36.97 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 571' ' ' ALA . . . . . 0.466 ' HB1' HH12 ' A' ' 582' ' ' ARG . . . -57.03 -32.32 66.06 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.959 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 33.9 p -100.18 -38.56 8.46 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.402 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 94.15 27.74 11.78 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.006 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 127.9 -31.78 3.62 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.419 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 575' ' ' ASP . . . . . 0.402 ' HB3' ' HB3' ' A' ' 578' ' ' ALA . 6.9 t0 -75.48 77.46 2.52 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.629 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.6 OUTLIER -63.95 -37.25 79.28 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.811 0 CA-C-N 114.775 -1.102 . . . . 0.0 111.243 -176.598 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 577' ' ' ASN . . . . . 0.556 ' HA ' HG13 ' A' ' 580' ' ' ILE . 7.8 m-80 -63.97 -42.37 97.27 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 124.207 0.942 . . . . 0.0 108.848 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 578' ' ' ALA . . . . . 0.408 ' O ' ' HD2' ' A' ' 582' ' ' ARG . . . -64.41 -39.5 93.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 113.969 -1.469 . . . . 0.0 107.605 177.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 579' ' ' ALA . . . . . 0.676 ' HA ' ' HD3' ' A' ' 582' ' ' ARG . . . -64.12 -35.43 80.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 114.4 -1.273 . . . . 0.0 110.503 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 580' ' ' ILE . . . . . 0.629 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.4 mt -63.4 -37.16 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 CA-C-O 121.205 0.526 . . . . 0.0 110.124 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -66.63 -44.4 82.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.326 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 582' ' ' ARG . . . . . 0.676 ' HD3' ' HA ' ' A' ' 579' ' ' ALA . 0.0 OUTLIER -80.46 -41.07 25.06 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.581 -0.447 . . . . 0.0 111.339 -178.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 583' ' ' LEU . . . . . 0.452 HD22 HD11 ' A' ' 554' ' ' LEU . 12.8 tp -58.07 -42.04 84.7 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.703 -178.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 584' ' ' LEU . . . . . 0.496 ' HB3' ' O ' ' A' ' 580' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.412 -2.349 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 177.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 546' ' ' ARG . . . . . 0.676 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.52 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 547' ' ' PHE . . . . . 0.567 ' HD2' HD22 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 22.95 37.37 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.224 1.564 . . . . 0.0 115.224 172.774 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 548' ' ' GLN . . . . . 0.697 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.9 pt20 28.31 -86.24 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 549' ' ' GLN . . . . . 0.697 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 25.7 mt-30 -73.33 -51.5 17.24 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.225 -177.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 550' ' ' GLN . . . . . 0.513 ' HB3' ' CD1' ' A' ' 569' ' ' LEU . 2.5 mp0 -51.36 -42.24 61.19 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-O 121.441 0.639 . . . . 0.0 110.759 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 551' ' ' LEU . . . . . 0.676 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -63.09 -39.21 94.05 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.353 177.685 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . 0.523 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 12.5 tt0 -51.78 -31.93 29.0 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.331 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 553' ' ' GLN . . . . . 0.543 ' HG2' HD11 ' A' ' 576' ' ' ILE . 1.7 mp0 -75.33 -58.84 3.04 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.755 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . 0.632 HD12 HD23 ' A' ' 583' ' ' LEU . 8.4 mt -55.1 -36.99 66.26 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 119.111 -1.036 . . . . 0.0 111.506 178.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 4.9 m -67.92 -37.34 81.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -53.97 -34.89 61.01 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.716 -0.675 . . . . 0.0 112.803 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 557' ' ' MET . . . . . 0.535 ' HG3' HG22 ' A' ' 580' ' ' ILE . 40.7 mmm -83.28 28.39 0.53 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.08 0.855 . . . . 0.0 111.786 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 74.44 40.84 38.66 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 115.361 0.904 . . . . 0.0 115.361 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -113.33 134.19 54.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 117.551 0.676 . . . . 0.0 109.943 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 93.5 mt -111.51 -1.04 15.99 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -178.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . 0.632 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 0.2 OUTLIER -81.75 102.64 10.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.148 0.499 . . . . 0.0 110.277 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 562' ' ' ARG . . . . . 0.589 ' HB3' ' NE ' ' A' ' 546' ' ' ARG . 18.2 mmt180 -57.94 -70.97 0.12 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.87 -178.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -49.41 -33.75 14.68 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.983 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 564' ' ' ALA . . . . . 0.632 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -76.03 -23.82 55.16 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . 0.563 ' O ' HD21 ' A' ' 569' ' ' LEU . 86.1 m-20 -79.56 -51.0 9.86 Favored 'General case' 0 CA--C 1.512 -0.49 0 C-N-CA 120.551 -0.459 . . . . 0.0 110.268 -178.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.61 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.4 OUTLIER -58.57 -43.86 89.56 Favored 'General case' 0 N--CA 1.424 -1.728 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.232 -178.702 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -66.13 -43.48 87.0 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.796 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 568' ' ' ALA . . . . . 0.44 ' HB1' ' HB2' ' A' ' 579' ' ' ALA . . . -56.99 -30.03 63.8 Favored 'General case' 0 C--N 1.312 -1.056 0 C-N-CA 118.901 -1.119 . . . . 0.0 108.031 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . 0.607 HD23 HG21 ' A' ' 576' ' ' ILE . 3.2 mm? -73.83 -46.0 47.8 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 75.5 mt -71.16 -43.43 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 CA-C-O 121.435 0.636 . . . . 0.0 109.348 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -57.51 -24.04 53.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.752 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 572' ' ' THR . . . . . 0.475 HG21 ' NH2' ' A' ' 582' ' ' ARG . 35.1 p -100.66 -37.58 8.69 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 120.217 -0.593 . . . . 0.0 109.857 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 92.75 30.56 9.49 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.896 -0.593 . . . . 0.0 113.682 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 119.41 -29.85 5.99 Favored Glycine 0 C--O 1.228 -0.262 0 C-N-CA 120.361 -0.923 . . . . 0.0 112.624 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 575' ' ' ASP . . . . . 0.471 ' HB3' ' HB2' ' A' ' 578' ' ' ALA . 1.2 t0 -72.65 82.73 1.14 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 178.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.615 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -71.81 -34.92 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.705 0 CA-C-N 115.243 -0.89 . . . . 0.0 111.204 -176.874 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 577' ' ' ASN . . . . . 0.635 ' HA ' HG13 ' A' ' 580' ' ' ILE . 9.6 m-80 -64.79 -45.15 87.52 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 122.121 0.962 . . . . 0.0 108.544 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 578' ' ' ALA . . . . . 0.471 ' HB2' ' HB3' ' A' ' 575' ' ' ASP . . . -63.14 -31.58 72.75 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 113.6 -1.637 . . . . 0.0 107.792 177.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 579' ' ' ALA . . . . . 0.44 ' HB2' ' HB1' ' A' ' 568' ' ' ALA . . . -75.61 -30.39 59.54 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.472 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 580' ' ' ILE . . . . . 0.635 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.7 mt -66.46 -49.62 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-O 121.383 0.611 . . . . 0.0 110.703 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . 0.632 ' HA ' HD23 ' A' ' 584' ' ' LEU . 41.5 tt0 -67.64 -33.75 75.58 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.443 -179.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 582' ' ' ARG . . . . . 0.475 ' NH2' HG21 ' A' ' 572' ' ' THR . 0.5 OUTLIER -76.61 -36.1 57.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.583 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 583' ' ' LEU . . . . . 0.632 HD23 HD12 ' A' ' 554' ' ' LEU . 7.9 tp -68.9 -35.32 76.72 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.188 -178.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 584' ' ' LEU . . . . . 0.632 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.415 -2.211 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 546' ' ' ARG . . . . . 0.684 ' HB3' ' HB2' ' A' ' 551' ' ' LEU . 11.3 mmt180 . . . . . 0 N--CA 1.432 -1.336 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 547' ' ' PHE . . . . . 0.569 ' HB2' HD12 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 64.1 31.01 13.7 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 117.919 -1.513 . . . . 0.0 109.085 178.076 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 548' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 30.92 -84.48 0.0 OUTLIER 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.64 -1.164 . . . . 0.0 113.77 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 549' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 547' ' ' PHE . 15.2 mm100 -73.32 -50.68 20.78 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.761 -176.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 550' ' ' GLN . . . . . 0.551 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 6.8 mp0 -49.23 -35.01 16.22 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.109 178.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 551' ' ' LEU . . . . . 0.684 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -65.65 -47.0 77.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.898 177.413 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . 0.569 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 6.2 tp10 -53.4 -32.71 50.8 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.821 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 553' ' ' GLN . . . . . 0.633 ' HB3' HG22 ' A' ' 576' ' ' ILE . 46.8 mt-30 -71.72 -58.29 3.61 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . 0.59 HD13 HD22 ' A' ' 583' ' ' LEU . 8.2 mt -60.38 -28.61 68.35 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 119.241 -0.984 . . . . 0.0 109.806 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 8.0 m -70.09 -39.5 75.54 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.483 ' C ' ' H ' ' A' ' 558' ' ' GLY . . . -55.6 -26.31 43.23 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.831 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 557' ' ' MET . . . . . 0.563 ' HG3' HD12 ' A' ' 580' ' ' ILE . 88.9 mmm -81.53 31.34 0.35 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.578 0.704 . . . . 0.0 110.419 178.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . 0.483 ' H ' ' C ' ' A' ' 556' ' ' ALA . . . 64.96 33.33 86.96 Favored Glycine 0 CA--C 1.522 0.498 0 CA-C-N 114.578 -1.192 . . . . 0.0 113.752 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -111.55 141.71 44.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.951 0.375 . . . . 0.0 110.284 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 561' ' ' ASN . 3.8 pp -117.17 -34.69 4.28 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.446 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . 0.447 ' N ' HD12 ' A' ' 560' ' ' LEU . 45.0 t-20 -51.36 95.36 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.054 0.454 . . . . 0.0 111.232 -179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 562' ' ' ARG . . . . . 0.539 ' HB3' ' HE ' ' A' ' 546' ' ' ARG . 14.6 mmt180 -55.78 -41.88 74.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.467 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -47.31 -51.29 19.69 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.886 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.5 -24.71 45.7 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.11 0.481 . . . . 0.0 111.016 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -59.89 -58.49 8.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.063 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.639 ' HB2' ' HA ' ' A' ' 546' ' ' ARG . 1.1 tp -67.13 -33.78 76.18 Favored 'General case' 0 N--CA 1.423 -1.798 0 O-C-N 122.291 -0.256 . . . . 0.0 110.837 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -70.56 -42.11 71.57 Favored 'General case' 0 CA--C 1.505 -0.782 0 C-N-CA 119.445 -0.902 . . . . 0.0 113.174 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 568' ' ' ALA . . . . . 0.522 ' HB1' ' HB2' ' A' ' 579' ' ' ALA . . . -64.92 -27.11 68.63 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . 0.473 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 2.9 mm? -71.24 -53.23 15.09 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.545 -178.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 69.3 mt -70.58 -36.43 65.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.059 0.457 . . . . 0.0 110.394 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -64.2 -23.99 67.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.46 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 572' ' ' THR . . . . . 0.623 HG22 HH21 ' A' ' 582' ' ' ARG . 68.6 p -105.16 -40.63 5.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 119.764 -0.775 . . . . 0.0 110.512 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 98.11 43.48 2.8 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.526 -0.845 . . . . 0.0 113.59 176.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 574' ' ' GLY . . . . . 0.616 ' O ' HG12 ' A' ' 576' ' ' ILE . . . 107.7 -32.83 6.77 Favored Glycine 0 C--O 1.227 -0.282 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.452 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -65.16 90.6 0.09 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.633 HG22 ' HB3' ' A' ' 553' ' ' GLN . 1.8 mm -70.56 -34.48 57.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.895 -177.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 577' ' ' ASN . . . . . 0.644 ' HA ' HG13 ' A' ' 580' ' ' ILE . 1.0 OUTLIER -67.29 -50.6 59.6 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.002 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -59.24 -30.59 68.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 113.99 -1.459 . . . . 0.0 107.644 177.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 579' ' ' ALA . . . . . 0.523 ' HB2' HD12 ' A' ' 554' ' ' LEU . . . -75.28 -30.54 60.46 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.122 -1.399 . . . . 0.0 111.533 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 580' ' ' ILE . . . . . 0.644 HG13 ' HA ' ' A' ' 577' ' ' ASN . 4.4 mt -65.97 -46.33 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-O 121.325 0.583 . . . . 0.0 110.574 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . 0.562 ' HA ' HD23 ' A' ' 584' ' ' LEU . 28.6 mm-40 -68.07 -36.56 80.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.815 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 582' ' ' ARG . . . . . 0.623 HH21 HG22 ' A' ' 572' ' ' THR . 1.9 ttp180 -76.43 -34.53 58.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.466 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 583' ' ' LEU . . . . . 0.59 HD22 HD13 ' A' ' 554' ' ' LEU . 6.8 tp -70.45 -33.01 70.81 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.87 -179.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 584' ' ' LEU . . . . . 0.562 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.415 -2.208 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 546' ' ' ARG . . . . . 0.776 HH11 ' HG3' ' A' ' 546' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.424 -1.728 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 547' ' ' PHE . . . . . 0.558 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.76 31.41 7.48 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 119.419 -0.912 . . . . 0.0 111.533 177.918 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 548' ' ' GLN . . . . . 0.448 ' O ' ' HG3' ' A' ' 552' ' ' GLU . 6.8 mt-30 29.15 -82.31 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.499 1.12 . . . . 0.0 113.894 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 549' ' ' GLN . . . . . 0.476 ' N ' ' O ' ' A' ' 547' ' ' PHE . 29.6 mm-40 -72.58 -51.35 20.16 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.839 -177.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 550' ' ' GLN . . . . . 0.558 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 13.2 mp0 -50.88 -38.95 52.71 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.149 0.976 . . . . 0.0 108.538 178.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 551' ' ' LEU . . . . . 0.772 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -59.69 -45.56 91.73 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 114.089 -1.414 . . . . 0.0 109.707 175.487 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . 0.587 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 57.3 mt-10 -52.82 -32.73 45.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.117 -178.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 553' ' ' GLN . . . . . 0.495 ' NE2' ' HA ' ' A' ' 550' ' ' GLN . 0.5 OUTLIER -76.09 -59.21 2.86 Favored 'General case' 0 C--O 1.245 0.859 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -179.836 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . 0.624 HD13 HD23 ' A' ' 583' ' ' LEU . 14.4 mt -63.28 -28.97 70.39 Favored 'General case' 0 C--N 1.346 0.449 0 C-N-CA 118.591 -1.244 . . . . 0.0 110.234 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 555' ' ' SER . . . . . 0.678 ' HB2' HH22 ' A' ' 546' ' ' ARG . 47.2 t -70.38 -38.19 74.68 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 177.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 552' ' ' GLU . . . -55.47 -26.38 42.04 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.795 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 557' ' ' MET . . . . . 0.486 ' HG3' HD12 ' A' ' 580' ' ' ILE . 0.0 OUTLIER -86.22 27.53 0.91 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.369 179.002 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 43.09 43.19 5.52 Favored Glycine 0 CA--C 1.523 0.535 0 CA-C-N 115.014 -0.994 . . . . 0.0 113.27 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 559' ' ' PHE . . . . . 0.445 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 1.9 m-85 -77.18 -40.48 45.15 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 27.7 mt 66.19 8.12 5.32 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 178.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 42.5 t-20 -110.97 82.5 1.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.626 0.25 . . . . 0.0 110.519 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 562' ' ' ARG . . . . . 0.495 ' HD3' HH12 ' A' ' 546' ' ' ARG . 19.6 mmt180 -57.05 -31.96 65.72 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.164 0.506 . . . . 0.0 111.443 -178.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.33 -52.67 60.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.56 -179.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -79.52 -25.38 41.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.423 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . 0.762 HD21 ' NH1' ' A' ' 546' ' ' ARG . 81.1 m-20 -60.23 -59.5 5.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.988 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.529 HD22 ' HD2' ' A' ' 547' ' ' PHE . 0.3 OUTLIER -66.12 -30.65 71.18 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.502 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -71.12 -33.06 69.77 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 119.23 -0.988 . . . . 0.0 111.642 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 568' ' ' ALA . . . . . 0.573 ' HB1' ' HB3' ' A' ' 579' ' ' ALA . . . -71.51 -28.47 63.92 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 177.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . 0.527 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.3 mm? -72.13 -53.52 12.48 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.975 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 90.0 mt -66.51 -38.51 81.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.552 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -70.42 -17.48 63.01 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.6 p -105.4 -40.87 5.67 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.026 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 92.84 42.1 4.51 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.886 176.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 113.14 -34.94 4.82 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.413 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.17 87.82 0.8 Allowed 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.58 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -77.25 -26.84 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.17 -176.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 577' ' ' ASN . . . . . 0.702 ' HA ' HG13 ' A' ' 580' ' ' ILE . 14.7 m-80 -68.53 -53.7 21.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -58.77 -29.65 66.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.053 -1.43 . . . . 0.0 107.632 177.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 579' ' ' ALA . . . . . 0.573 ' HB3' ' HB1' ' A' ' 568' ' ' ALA . . . -75.06 -27.64 60.06 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 114.121 -1.4 . . . . 0.0 110.934 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 580' ' ' ILE . . . . . 0.702 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.5 mt -68.74 -45.26 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.193 0.52 . . . . 0.0 110.398 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . 0.69 ' HA ' HD23 ' A' ' 584' ' ' LEU . 36.1 tt0 -68.32 -37.52 80.66 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.814 -178.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 582' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 582' ' ' ARG . 0.0 OUTLIER -76.26 -31.75 58.46 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.965 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 583' ' ' LEU . . . . . 0.624 HD23 HD13 ' A' ' 554' ' ' LEU . 7.5 tp -71.23 -25.67 62.59 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-O 121.306 0.574 . . . . 0.0 109.705 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 584' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.415 -2.182 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.597 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 546' ' ' ARG . . . . . 0.807 HH11 ' HG3' ' A' ' 546' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.422 -1.857 0 N-CA-C 113.024 0.749 . . . . 0.0 113.024 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 547' ' ' PHE . . . . . 0.518 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 65.92 29.94 10.07 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.134 178.196 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 548' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 30.4 -83.32 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 124.672 1.189 . . . . 0.0 113.953 179.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 549' ' ' GLN . . . . . 0.45 ' N ' ' O ' ' A' ' 547' ' ' PHE . 21.6 mt-30 -72.19 -50.99 23.25 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.221 -177.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 550' ' ' GLN . . . . . 0.746 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 0.9 OUTLIER -50.87 -33.05 22.3 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 122.579 1.181 . . . . 0.0 108.501 177.819 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 551' ' ' LEU . . . . . 0.767 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -65.3 -45.08 85.78 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.767 175.488 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . 0.551 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 24.4 mm-40 -53.81 -37.76 63.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.136 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 553' ' ' GLN . . . . . 0.753 HE22 ' HG ' ' A' ' 554' ' ' LEU . 3.5 pp0? -72.88 -56.71 4.8 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 120.336 -0.546 . . . . 0.0 112.047 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . 0.753 ' HG ' HE22 ' A' ' 553' ' ' GLN . 11.5 mt -58.69 -29.71 66.84 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 118.359 -1.336 . . . . 0.0 110.087 178.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 47.2 t -68.95 -40.05 79.18 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -56.66 -27.38 58.49 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.982 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 95.6 mmm -89.94 21.97 3.39 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.708 0.766 . . . . 0.0 109.102 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 47.84 36.79 14.22 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 114.205 -1.361 . . . . 0.0 113.363 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 559' ' ' PHE . . . . . 0.493 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 0.3 OUTLIER -61.65 -42.99 99.67 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.546 -0.461 . . . . 0.0 111.672 179.351 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 63.2 mt 63.22 1.94 1.02 Allowed 'General case' 0 C--O 1.232 0.146 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -108.04 85.55 2.14 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 562' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -56.05 -50.76 70.06 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.78 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -47.4 -51.36 20.12 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.271 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.94 -25.22 43.62 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.279 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . 0.755 HD21 ' NH1' ' A' ' 546' ' ' ARG . 89.3 m-20 -60.44 -59.74 4.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.565 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.543 HD12 ' HA ' ' A' ' 546' ' ' ARG . 2.1 tp -62.04 -29.49 70.32 Favored 'General case' 0 N--CA 1.421 -1.875 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 567' ' ' GLN . . . . . 0.48 HE21 ' HA ' ' A' ' 567' ' ' GLN . 0.1 OUTLIER -68.1 -33.98 75.54 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.171 179.099 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 568' ' ' ALA . . . . . 0.566 ' HB1' HD12 ' A' ' 554' ' ' LEU . . . -75.94 -43.34 45.38 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.809 0.338 . . . . 0.0 110.913 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . 0.746 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.9 mm? -58.99 -48.56 81.15 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.021 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 84.1 mt -71.78 -40.67 69.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.244 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 571' ' ' ALA . . . . . 0.425 ' CB ' ' O ' ' A' ' 567' ' ' GLN . . . -58.76 -19.45 40.64 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 25.3 p -114.57 -39.92 3.69 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.659 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 89.32 46.44 4.38 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.059 177.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 574' ' ' GLY . . . . . 0.575 ' O ' HG12 ' A' ' 576' ' ' ILE . . . 109.57 -26.97 13.06 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.337 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.55 86.7 0.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.61 ' O ' HG13 ' A' ' 580' ' ' ILE . 7.2 mm -68.1 -44.77 84.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.204 -176.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 577' ' ' ASN . . . . . 0.55 ' HA ' HG13 ' A' ' 580' ' ' ILE . 10.9 m-80 -67.28 -53.58 28.52 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.391 -177.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -57.85 -31.0 66.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.686 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 579' ' ' ALA . . . . . 0.484 ' O ' ' HB3' ' A' ' 583' ' ' LEU . . . -75.31 -29.32 60.0 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.339 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 580' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 576' ' ' ILE . 1.9 mt -69.4 -47.12 74.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-O 120.971 0.415 . . . . 0.0 111.355 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . 0.609 ' HA ' HD23 ' A' ' 584' ' ' LEU . 40.8 tt0 -69.69 -38.48 77.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.528 -178.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 582' ' ' ARG . . . . . 0.631 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -75.23 -32.15 61.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.583 -179.092 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 583' ' ' LEU . . . . . 0.631 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 8.9 tp -71.69 -32.0 67.36 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.721 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 584' ' ' LEU . . . . . 0.609 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.409 -2.479 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 546' ' ' ARG . . . . . 0.657 ' CZ ' ' HB2' ' A' ' 565' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.41 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 547' ' ' PHE . . . . . 0.528 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.9 15.52 10.16 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 119.302 -0.959 . . . . 0.0 109.432 -179.183 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 548' ' ' GLN . . . . . 0.465 ' HA ' HD23 ' A' ' 551' ' ' LEU . 1.5 mt-30 34.69 -79.6 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.777 177.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 549' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 547' ' ' PHE . 95.5 mt-30 -72.07 -51.9 19.41 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.071 -177.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 550' ' ' GLN . . . . . 0.602 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 2.5 mp0 -52.45 -40.49 62.33 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 115.526 -0.761 . . . . 0.0 108.991 177.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 551' ' ' LEU . . . . . 0.648 ' HA ' HH22 ' A' ' 546' ' ' ARG . 0.1 OUTLIER -60.01 -45.55 92.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.138 176.813 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . 0.598 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 10.1 mm-40 -53.73 -31.8 49.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.605 -179.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 553' ' ' GLN . . . . . 0.561 ' HB3' HG22 ' A' ' 576' ' ' ILE . 7.0 mt-30 -75.78 -59.02 2.94 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . 0.561 HD21 HG23 ' A' ' 576' ' ' ILE . 10.9 mt -60.68 -30.37 69.88 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 119.681 1.128 . . . . 0.0 110.041 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 555' ' ' SER . . . . . 0.43 ' OG ' HD11 ' A' ' 551' ' ' LEU . 46.7 m -70.26 -42.05 72.66 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -56.48 -22.03 29.72 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.935 178.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 557' ' ' MET . . . . . 0.466 ' HE1' HD12 ' A' ' 580' ' ' ILE . 87.9 mmm -95.53 22.09 7.46 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.181 0.515 . . . . 0.0 110.408 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 55.43 46.33 80.89 Favored Glycine 0 CA--C 1.52 0.372 0 CA-C-N 115.492 -0.776 . . . . 0.0 113.318 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 559' ' ' PHE . . . . . 0.642 ' CE2' ' HG ' ' A' ' 583' ' ' LEU . 0.6 OUTLIER -65.7 -42.69 90.88 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.722 0.261 . . . . 0.0 111.473 179.475 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . 0.548 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 57.2 mt 75.42 11.35 3.37 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 176.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -146.14 95.87 2.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.834 0.35 . . . . 0.0 110.288 178.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 562' ' ' ARG . . . . . 0.556 ' HA ' ' ND2' ' A' ' 565' ' ' ASN . 22.9 mmt180 -57.14 -58.52 7.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.89 -178.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -53.63 -33.31 54.68 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.816 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -75.71 -24.41 56.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.374 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . 0.657 ' HB2' ' CZ ' ' A' ' 546' ' ' ARG . 16.8 m-20 -70.84 -50.91 30.26 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.634 ' HB2' ' NE ' ' A' ' 546' ' ' ARG . 1.0 OUTLIER -51.73 -48.1 63.76 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -54.42 -46.23 73.16 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.735 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 568' ' ' ALA . . . . . . . . . . . . . . . -67.34 -41.66 84.84 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 111.619 0.229 . . . . 0.0 111.619 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . 0.602 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.5 mm? -63.44 -42.56 98.67 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 120.843 0.354 . . . . 0.0 111.921 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 30.7 mm -64.44 -35.13 73.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.173 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -87.53 -17.12 32.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.105 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 572' ' ' THR . . . . . 0.571 ' HB ' ' HB3' ' A' ' 575' ' ' ASP . 76.4 p -106.43 0.82 25.11 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 53.7 30.73 44.14 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.931 -0.652 . . . . 0.0 113.773 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 102.52 -2.16 49.69 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.891 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 575' ' ' ASP . . . . . 0.571 ' HB3' ' HB ' ' A' ' 572' ' ' THR . 2.6 t0 -77.75 77.73 4.26 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.604 ' O ' HG13 ' A' ' 580' ' ' ILE . 10.4 mm -58.18 -35.08 51.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.941 -177.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 577' ' ' ASN . . . . . 0.64 ' HA ' HG13 ' A' ' 580' ' ' ILE . 5.9 m-80 -67.76 -45.14 75.77 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.036 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 578' ' ' ALA . . . . . 0.493 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -61.88 -34.49 76.11 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.502 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 579' ' ' ALA . . . . . 0.441 ' HB1' HD12 ' A' ' 554' ' ' LEU . . . -71.83 -30.98 66.06 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.893 -1.048 . . . . 0.0 110.915 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 580' ' ' ILE . . . . . 0.64 HG13 ' HA ' ' A' ' 577' ' ' ASN . 3.5 mt -61.1 -56.82 15.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.616 0 CA-C-O 121.364 0.602 . . . . 0.0 110.839 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -65.36 -29.66 70.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.116 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 582' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -77.13 -47.64 19.87 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 583' ' ' LEU . . . . . 0.642 ' HG ' ' CE2' ' A' ' 559' ' ' PHE . 3.3 tm? -53.49 -58.04 8.56 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-O 121.212 0.529 . . . . 0.0 110.938 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 584' ' ' LEU . . . . . . . . . . . . . 3.5 mt . . . . . 0 N--CA 1.394 -3.245 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.178 -179.749 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 546' ' ' ARG . . . . . 0.708 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 10.4 mmt180 . . . . . 0 C--O 1.223 -0.298 0 CA-C-O 120.616 0.246 . . . . 0.0 111.461 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 547' ' ' PHE . . . . . 0.63 ' HB2' ' HG ' ' A' ' 566' ' ' LEU . 0.1 OUTLIER 32.4 37.85 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 176.712 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 548' ' ' GLN . . . . . 0.708 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 4.7 pt20 23.87 -84.12 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.299 1.04 . . . . 0.0 113.631 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 549' ' ' GLN . . . . . 0.708 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 4.5 pt20 -73.76 -50.33 21.16 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.635 -177.004 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 550' ' ' GLN . . . . . 0.722 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 1.3 mm100 -50.09 -44.09 51.76 Favored 'General case' 0 C--O 1.25 1.082 0 CA-C-O 121.654 0.74 . . . . 0.0 111.541 -178.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 551' ' ' LEU . . . . . 0.708 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -72.64 -34.27 67.18 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.6 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -52.17 -32.24 35.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 553' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 549' ' ' GLN . 1.7 mp0 -74.39 -58.53 3.23 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.02 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . 0.59 HD23 HD21 ' A' ' 583' ' ' LEU . 12.5 mt -60.38 -29.29 68.84 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 118.59 -1.244 . . . . 0.0 110.775 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 555' ' ' SER . . . . . 0.516 ' HB2' HD11 ' A' ' 551' ' ' LEU . 25.3 t -70.18 -37.4 75.13 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.498 ' C ' ' H ' ' A' ' 558' ' ' GLY . . . -55.14 -27.98 49.38 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.794 178.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 557' ' ' MET . . . . . 0.466 ' O ' ' SD ' ' A' ' 557' ' ' MET . 0.0 OUTLIER -81.73 19.51 1.06 Allowed 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 122.586 1.184 . . . . 0.0 109.111 178.642 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 558' ' ' GLY . . . . . 0.498 ' H ' ' C ' ' A' ' 556' ' ' ALA . . . 52.81 48.97 56.08 Favored Glycine 0 CA--C 1.524 0.61 0 CA-C-N 114.723 -1.126 . . . . 0.0 113.57 -178.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 559' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 560' ' ' LEU . 0.8 OUTLIER -74.86 -36.82 62.32 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 179.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 560' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 56.5 mt 74.0 3.54 4.44 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 178.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -125.6 95.54 4.48 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 562' ' ' ARG . . . . . 0.464 ' HB2' ' HE ' ' A' ' 546' ' ' ARG . 8.2 mmm180 -60.2 -63.15 1.4 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.374 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -50.17 -38.58 40.33 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.143 0.497 . . . . 0.0 111.934 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -68.73 -24.96 64.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.779 -178.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . 0.558 HD21 HD12 ' A' ' 551' ' ' LEU . 29.6 m-20 -80.26 -51.17 9.24 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 566' ' ' LEU . . . . . 0.702 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.5 OUTLIER -51.5 -36.45 44.68 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -177.925 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -68.57 -42.84 77.73 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.564 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 568' ' ' ALA . . . . . 0.614 ' HB1' ' HB2' ' A' ' 579' ' ' ALA . . . -61.53 -28.35 69.26 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.763 176.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . 0.722 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 4.3 mm? -72.54 -52.08 17.18 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.47 -178.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 89.1 mt -67.8 -39.5 82.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.175 0.512 . . . . 0.0 109.779 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -63.19 -19.64 64.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.564 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 34.6 p -108.23 -39.57 5.43 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 119.739 -0.785 . . . . 0.0 110.31 179.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 91.07 39.77 5.67 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.859 -0.686 . . . . 0.0 113.179 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 114.93 -30.18 6.99 Favored Glycine 0 C--N 1.333 0.391 0 C-N-CA 120.32 -0.943 . . . . 0.0 112.676 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -75.89 85.94 2.84 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 576' ' ' ILE . . . . . 0.584 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -73.99 -28.14 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.664 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.931 -177.244 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 577' ' ' ASN . . . . . 0.68 ' HA ' HG13 ' A' ' 580' ' ' ILE . 14.7 m-80 -68.73 -53.28 22.95 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 124.257 0.973 . . . . 0.0 108.722 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -60.08 -30.04 68.97 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.258 -1.337 . . . . 0.0 107.756 177.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 579' ' ' ALA . . . . . 0.614 ' HB2' ' HB1' ' A' ' 568' ' ' ALA . . . -74.25 -28.89 61.44 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.777 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 580' ' ' ILE . . . . . 0.68 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.2 mt -67.01 -42.38 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-O 121.302 0.572 . . . . 0.0 110.286 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 581' ' ' GLU . . . . . 0.548 ' HA ' HD23 ' A' ' 584' ' ' LEU . 37.7 tt0 -69.89 -40.49 75.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.826 -178.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 582' ' ' ARG . . . . . 0.663 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -76.32 -35.14 58.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.148 -178.554 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 583' ' ' LEU . . . . . 0.663 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 13.4 tp -71.45 -32.24 68.1 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-O 121.072 0.463 . . . . 0.0 110.371 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 584' ' ' LEU . . . . . 0.583 ' HB3' ' O ' ' A' ' 580' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.41 -2.43 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.163 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 76.0 p -158.24 72.34 3.96 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.674 0.273 . . . . 0.0 111.015 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -79.97 -178.29 4.42 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.551 2.168 . . . . 0.0 111.959 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -103.83 117.72 35.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.003 0.43 . . . . 0.0 110.544 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' PHE . . . . . 0.479 ' O ' HD11 ' A' ' 566' ' ' LEU . 87.9 m-85 -58.4 -12.32 3.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.573 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -61.53 -53.13 60.44 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.686 0.279 . . . . 0.0 111.644 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . 0.461 ' HB3' ' HG2' ' A' ' 544' ' ' GLU . 90.8 m-20 -52.95 137.1 46.56 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.22 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . 0.518 ' HA ' HD22 ' A' ' 566' ' ' LEU . 92.7 Cg_endo -78.73 5.22 5.78 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.524 2.149 . . . . 0.0 112.358 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 544' ' ' GLU . . . . . 0.461 ' HG2' ' HB3' ' A' ' 542' ' ' ASN . 10.4 pt-20 -73.48 -54.22 8.76 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 545' ' ' VAL . . . . . 0.425 ' N ' ' HG3' ' A' ' 544' ' ' GLU . 97.0 t -61.51 -40.33 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 546' ' ' ARG . . . . . 0.631 ' HA ' ' HB2' ' A' ' 566' ' ' LEU . 5.8 mtm180 65.07 30.28 11.72 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.227 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 547' ' ' PHE . . . . . 0.621 ' N ' HD13 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 63.99 18.23 11.08 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 -177.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 548' ' ' GLN . . . . . 0.443 ' HA ' HD23 ' A' ' 551' ' ' LEU . 1.8 mt-30 29.89 -78.7 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 113.773 -1.558 . . . . 0.0 114.133 177.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 549' ' ' GLN . . . . . 0.548 ' O ' ' HB3' ' A' ' 552' ' ' GLU . 15.0 mm100 -71.4 -50.82 28.15 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.425 -177.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 550' ' ' GLN . . . . . 0.761 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 4.1 mm100 -52.09 -40.67 61.58 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.088 -0.96 . . . . 0.0 108.874 178.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 551' ' ' LEU . . . . . 0.526 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -62.63 -40.74 97.96 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.724 177.706 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . 0.548 ' HB3' ' O ' ' A' ' 549' ' ' GLN . 5.1 tp10 -53.59 -32.12 49.73 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.55 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . 0.473 ' NE2' ' HA ' ' A' ' 550' ' ' GLN . 0.4 OUTLIER -77.39 -58.46 3.26 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 118.826 -0.607 . . . . 0.0 112.614 179.611 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . 0.637 HD11 HD23 ' A' ' 583' ' ' LEU . 10.9 mt -57.85 -32.43 67.63 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 120.43 1.468 . . . . 0.0 110.369 178.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 44.9 t -68.9 -40.16 79.3 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -55.35 -27.17 45.51 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.503 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 557' ' ' MET . . . . . 0.532 ' HG3' HD11 ' A' ' 580' ' ' ILE . 26.5 mmm -89.31 24.98 2.03 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.898 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 75.56 39.94 33.68 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 115.416 0.926 . . . . 0.0 115.416 178.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 559' ' ' PHE . . . . . 0.495 ' HB2' ' O ' ' A' ' 554' ' ' LEU . 10.3 m-85 -104.44 126.89 51.95 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 118.189 0.995 . . . . 0.0 110.662 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 87.9 mt -96.31 -18.85 19.69 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -77.18 82.2 3.67 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 562' ' ' ARG . . . . . 0.585 ' HA ' ' ND2' ' A' ' 565' ' ' ASN . 15.6 mmt180 -59.89 -53.54 56.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.791 -177.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . 0.434 ' HG3' ' HB2' ' A' ' 543' ' ' PRO . 1.8 mp0 -52.33 -31.85 35.2 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.457 0.646 . . . . 0.0 110.794 178.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -73.47 -23.24 60.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.012 -178.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . 0.585 ' ND2' ' HA ' ' A' ' 562' ' ' ARG . 14.8 m-20 -78.65 -47.8 16.32 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.631 ' HB2' ' HA ' ' A' ' 546' ' ' ARG . 0.6 OUTLIER -52.48 -47.92 66.23 Favored 'General case' 0 N--CA 1.42 -1.926 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.772 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -72.34 -38.12 68.69 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.981 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 568' ' ' ALA . . . . . 0.495 ' HB3' ' HB1' ' A' ' 579' ' ' ALA . . . -60.39 -31.89 70.79 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 118.93 -1.108 . . . . 0.0 108.424 178.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . 0.761 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 4.0 mm? -73.84 -37.43 64.82 Favored 'General case' 0 N--CA 1.428 -1.561 0 CA-C-O 120.893 0.377 . . . . 0.0 111.818 -178.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 22.7 mm -65.43 -38.6 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.778 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -81.13 -15.53 55.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.394 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 572' ' ' THR . . . . . 0.463 HG21 ' HB3' ' A' ' 579' ' ' ALA . 39.6 p -104.86 4.59 32.23 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 47.4 32.01 7.05 Favored Glycine 0 C--N 1.337 0.585 0 N-CA-C 115.027 0.771 . . . . 0.0 115.027 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 574' ' ' GLY . . . . . 0.425 ' HA2' ' NE2' ' A' ' 550' ' ' GLN . . . 108.1 -17.46 34.85 Favored Glycine 0 C--O 1.229 -0.178 0 C-N-CA 120.078 -1.058 . . . . 0.0 113.212 179.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 575' ' ' ASP . . . . . 0.44 ' HB3' ' HB3' ' A' ' 578' ' ' ALA . 3.3 m-20 -75.27 78.82 2.37 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.657 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -67.54 -33.86 64.77 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.976 -177.079 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 577' ' ' ASN . . . . . 0.592 ' HA ' HG13 ' A' ' 580' ' ' ILE . 1.0 OUTLIER -66.29 -46.68 76.15 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 124.334 1.021 . . . . 0.0 108.697 179.872 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 578' ' ' ALA . . . . . 0.44 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -62.55 -31.04 71.76 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.981 -1.463 . . . . 0.0 107.742 177.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . 0.495 ' HB1' ' HB3' ' A' ' 568' ' ' ALA . . . -74.26 -33.9 63.44 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.271 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 580' ' ' ILE . . . . . 0.657 HG13 ' O ' ' A' ' 576' ' ' ILE . 3.7 mt -62.78 -44.02 99.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 121.444 0.64 . . . . 0.0 110.431 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . 0.427 ' HA ' HD22 ' A' ' 584' ' ' LEU . 39.7 mt-10 -68.94 -39.17 79.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.711 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 582' ' ' ARG . . . . . . . . . . . . . 2.2 ttt85 -77.44 -40.8 42.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.406 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 583' ' ' LEU . . . . . 0.637 HD23 HD11 ' A' ' 554' ' ' LEU . 8.2 tp -62.52 -44.58 96.01 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.624 -177.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 584' ' ' LEU . . . . . 0.431 ' O ' HD13 ' A' ' 584' ' ' LEU . 0.2 OUTLIER -69.14 -18.96 64.01 Favored 'General case' 0 N--CA 1.42 -1.972 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -58.37 -73.75 0.43 Allowed Glycine 0 C--N 1.335 0.507 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.811 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 54.2 m -147.62 -61.54 0.27 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.892 0.377 . . . . 0.0 110.513 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.945 179.948 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' SER . . . . . 0.558 ' HB3' ' HD3' ' A' ' 538' ' ' PRO . 42.4 t -92.94 -49.67 0.28 Allowed Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 111.539 0.199 . . . . 0.0 111.539 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' A' ' 537' ' ' SER . 8.8 Cg_exo -72.09 -147.86 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.413 2.076 . . . . 0.0 112.378 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 62.92 -99.51 0.08 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.213 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -61.96 -6.14 2.63 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -74.62 -59.92 2.51 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.424 -0.51 . . . . 0.0 109.671 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -131.48 149.91 74.88 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.332 177.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -84.46 17.73 1.68 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.654 2.236 . . . . 0.0 111.492 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 544' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -74.16 -55.51 5.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.821 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 545' ' ' VAL . . . . . 0.506 ' O ' ' HB2' ' A' ' 546' ' ' ARG . 47.6 t -65.74 -38.93 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 546' ' ' ARG . . . . . 0.578 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 6.3 mtm180 70.37 36.07 1.86 Allowed 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.284 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 547' ' ' PHE . . . . . 0.542 ' N ' HD11 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 59.34 22.6 10.99 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 -178.13 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 548' ' ' GLN . . . . . 0.698 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.9 pt20 29.42 -79.16 0.0 OUTLIER 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.516 1.527 . . . . 0.0 114.325 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 549' ' ' GLN . . . . . 0.698 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 24.6 mt-30 -71.7 -49.84 35.79 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.752 0.787 . . . . 0.0 111.006 -177.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 550' ' ' GLN . . . . . 0.605 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 11.2 mp0 -52.28 -40.33 61.63 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.345 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 551' ' ' LEU . . . . . 0.578 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -60.22 -40.23 89.43 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.749 176.684 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . 0.51 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 42.1 mt-10 -53.33 -32.35 48.62 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.752 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . 0.434 ' CD ' HD13 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -78.29 -59.02 2.95 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 118.925 -0.56 . . . . 0.0 112.057 179.667 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . 0.636 HD23 HG12 ' A' ' 580' ' ' ILE . 8.1 mt -54.28 -33.02 57.75 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 120.092 1.315 . . . . 0.0 110.992 177.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 48.4 t -69.91 -39.8 75.99 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.35 -33.46 59.09 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 43.1 mmm -97.58 22.09 9.42 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.177 0.898 . . . . 0.0 111.077 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . 0.413 ' O ' ' O ' ' A' ' 559' ' ' PHE . . . 117.14 -118.85 4.26 Favored Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 559' ' ' PHE . . . . . 0.433 ' HD1' HD22 ' A' ' 561' ' ' ASN . 90.4 m-85 29.85 112.01 0.0 OUTLIER 'General case' 0 C--O 1.232 0.139 0 N-CA-C 116.018 1.859 . . . . 0.0 116.018 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 68.3 mt -107.83 8.92 28.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.533 178.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . 0.463 ' HB2' ' HB3' ' A' ' 564' ' ' ALA . 0.3 OUTLIER -87.9 105.75 17.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.136 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 562' ' ' ARG . . . . . 0.56 ' HB3' ' HD3' ' A' ' 546' ' ' ARG . 24.2 mmt180 -59.6 -68.75 0.25 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.555 -178.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -32.11 31.15 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.217 -179.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 564' ' ' ALA . . . . . 0.463 ' HB3' ' HB2' ' A' ' 561' ' ' ASN . . . -76.76 -24.72 52.96 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -177.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . 0.604 ' O ' HD22 ' A' ' 569' ' ' LEU . 86.1 m-20 -78.68 -49.84 12.45 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 120.816 0.341 . . . . 0.0 110.61 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.542 HD11 ' N ' ' A' ' 547' ' ' PHE . 1.1 tp -57.31 -45.77 83.88 Favored 'General case' 0 N--CA 1.421 -1.883 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.139 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -71.94 -40.22 68.88 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 568' ' ' ALA . . . . . 0.499 ' HB1' HD13 ' A' ' 554' ' ' LEU . . . -57.29 -30.32 64.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.21 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . 0.639 HD12 HD12 ' A' ' 576' ' ' ILE . 3.3 mm? -72.68 -34.93 67.54 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.496 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 39.1 mm -73.86 -42.1 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-O 121.474 0.654 . . . . 0.0 109.246 179.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -57.62 -29.21 64.34 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.726 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 32.0 p -99.37 -38.73 8.72 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.766 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 93.88 27.47 12.53 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.891 -0.671 . . . . 0.0 113.227 177.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 126.28 -33.04 3.58 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.49 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.8 79.64 1.13 Allowed 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.639 HD12 HD12 ' A' ' 569' ' ' LEU . 0.3 OUTLIER -64.83 -36.09 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.927 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.12 -176.819 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 577' ' ' ASN . . . . . 0.611 ' HA ' HG13 ' A' ' 580' ' ' ILE . 1.0 OUTLIER -65.22 -40.2 93.8 Favored 'General case' 0 N--CA 1.442 -0.834 0 O-C-N 124.324 1.015 . . . . 0.0 108.501 179.223 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -66.59 -33.26 75.28 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.027 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . 0.493 ' HA ' ' HG2' ' A' ' 582' ' ' ARG . . . -73.51 -33.64 64.87 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.855 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 580' ' ' ILE . . . . . 0.636 HG12 HD23 ' A' ' 554' ' ' LEU . 2.8 mt -61.62 -48.67 87.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 121.494 0.664 . . . . 0.0 110.599 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . 0.503 ' HA ' HD21 ' A' ' 584' ' ' LEU . 37.4 tt0 -67.67 -36.83 81.44 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.895 -178.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 582' ' ' ARG . . . . . 0.633 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -77.87 -38.98 44.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.183 0.516 . . . . 0.0 110.647 -179.199 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 583' ' ' LEU . . . . . 0.633 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 11.2 tp -63.91 -40.41 96.43 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 123.674 0.79 . . . . 0.0 110.878 -178.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 584' ' ' LEU . . . . . 0.503 HD21 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER -79.77 -17.16 54.1 Favored 'General case' 0 N--CA 1.419 -2.021 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -76.36 7.87 28.84 Favored Glycine 0 C--N 1.334 0.454 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.757 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 77.9 p -143.48 52.7 1.34 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 0.0 110.87 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.062 -179.819 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.523 -0.231 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' SER . . . . . 0.608 ' H ' ' HD2' ' A' ' 538' ' ' PRO . 66.1 m -157.37 -53.5 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.338 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' PRO . . . . . 0.608 ' HD2' ' H ' ' A' ' 537' ' ' SER . 73.2 Cg_endo -75.11 87.45 1.33 Allowed 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.041 1.827 . . . . 0.0 112.317 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -131.14 -46.01 1.01 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.653 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -69.64 -30.59 68.34 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.677 0.275 . . . . 0.0 111.13 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -59.28 -48.58 81.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.236 -179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -62.89 137.99 97.03 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.109 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -80.89 10.07 3.52 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.607 2.205 . . . . 0.0 112.859 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 544' ' ' GLU . . . . . 0.5 ' HG3' ' H ' ' A' ' 545' ' ' VAL . 7.8 pt-20 -72.54 -55.61 6.67 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 545' ' ' VAL . . . . . 0.5 ' H ' ' HG3' ' A' ' 544' ' ' GLU . 55.5 t -67.94 -39.18 81.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 546' ' ' ARG . . . . . 0.775 HH11 ' HG3' ' A' ' 546' ' ' ARG . 0.0 OUTLIER 72.58 38.01 0.83 Allowed 'General case' 0 N--CA 1.421 -1.921 0 CA-C-N 114.247 -1.342 . . . . 0.0 112.361 179.097 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 547' ' ' PHE . . . . . 0.527 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.08 28.69 10.25 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 119.322 -0.951 . . . . 0.0 109.713 178.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 548' ' ' GLN . . . . . 0.674 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 6.5 pt20 28.16 -81.6 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 125.004 1.322 . . . . 0.0 114.228 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 549' ' ' GLN . . . . . 0.674 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 3.7 pt20 -73.34 -50.07 23.95 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.334 -178.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 550' ' ' GLN . . . . . 0.666 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 11.9 mp0 -50.11 -36.26 29.01 Favored 'General case' 0 C--O 1.245 0.843 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 177.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 551' ' ' LEU . . . . . 0.717 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -62.68 -45.15 94.13 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 114.137 -1.392 . . . . 0.0 109.928 177.0 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . 0.57 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 14.6 mm-40 -52.87 -32.09 42.97 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.362 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . 0.598 ' HG3' HD13 ' A' ' 576' ' ' ILE . 8.5 mm-40 -73.61 -60.24 2.34 Favored 'General case' 0 C--O 1.246 0.894 0 N-CA-C 112.424 0.528 . . . . 0.0 112.424 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . 0.805 HD12 HD23 ' A' ' 583' ' ' LEU . 11.6 mt -62.91 -29.86 71.1 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.535 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 555' ' ' SER . . . . . 0.543 ' HB2' HD11 ' A' ' 551' ' ' LEU . 46.7 t -69.73 -38.47 76.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -55.91 -26.58 48.21 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.434 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 557' ' ' MET . . . . . 0.537 ' HG3' HD13 ' A' ' 580' ' ' ILE . 84.8 mmm -87.34 25.32 1.42 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.317 0.58 . . . . 0.0 110.138 178.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 44.31 44.15 7.73 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-N 114.728 -1.124 . . . . 0.0 113.633 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 559' ' ' PHE . . . . . 0.466 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 1.6 m-85 -76.11 -41.96 48.6 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 113.353 0.872 . . . . 0.0 113.353 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 23.4 mt 66.28 7.15 4.68 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 178.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . 0.424 ' C ' HD21 ' A' ' 561' ' ' ASN . 0.2 OUTLIER -108.98 79.56 1.23 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 179.398 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 562' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -58.65 -29.07 66.26 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.59 -178.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -65.16 -51.84 58.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.075 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.81 -25.1 44.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.253 -178.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . 0.747 HD21 ' NH1' ' A' ' 546' ' ' ARG . 90.0 m-20 -60.8 -58.02 10.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.781 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.555 HD13 ' HA ' ' A' ' 546' ' ' ARG . 2.1 tp -63.82 -30.95 71.99 Favored 'General case' 0 N--CA 1.424 -1.751 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -69.9 -32.01 70.1 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.385 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 568' ' ' ALA . . . . . 0.57 ' HB3' ' HB1' ' A' ' 579' ' ' ALA . . . -77.36 -38.91 49.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.859 0.362 . . . . 0.0 110.768 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . 0.666 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.9 mm? -64.05 -49.56 71.87 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.224 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 83.4 mt -70.07 -39.74 77.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.259 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -67.96 -15.33 63.56 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 48.7 p -108.13 -40.89 5.07 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 119.756 -0.778 . . . . 0.0 110.324 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 94.42 43.45 3.71 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.378 -0.915 . . . . 0.0 112.652 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 110.84 -33.42 5.91 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.343 -0.932 . . . . 0.0 112.271 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.96 87.51 1.33 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.598 HD13 ' HG3' ' A' ' 553' ' ' GLN . 0.6 OUTLIER -77.62 -27.0 15.28 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.425 -176.836 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 577' ' ' ASN . . . . . 0.695 ' HA ' HG13 ' A' ' 580' ' ' ILE . 0.9 OUTLIER -68.84 -53.64 20.27 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.867 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -58.44 -29.87 66.49 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.249 -1.341 . . . . 0.0 107.76 176.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . 0.57 ' HB1' ' HB3' ' A' ' 568' ' ' ALA . . . -74.82 -27.44 60.29 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.12 -1.4 . . . . 0.0 110.929 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 580' ' ' ILE . . . . . 0.695 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.3 mt -69.51 -43.42 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 121.081 0.467 . . . . 0.0 110.604 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . 0.64 ' HA ' HD23 ' A' ' 584' ' ' LEU . 41.6 tt0 -69.49 -38.02 77.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.217 -178.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 582' ' ' ARG . . . . . 0.665 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -75.41 -32.12 60.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.497 -179.335 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 583' ' ' LEU . . . . . 0.805 HD23 HD12 ' A' ' 554' ' ' LEU . 8.1 tp -72.14 -31.89 66.41 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.79 -178.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 584' ' ' LEU . . . . . 0.64 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.1 OUTLIER -78.9 -13.57 59.72 Favored 'General case' 0 N--CA 1.408 -2.531 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 96.17 -7.36 66.8 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-N 114.539 -1.209 . . . . 0.0 112.837 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 586' ' ' SER . . . . . 0.634 ' H ' ' HG ' ' A' ' 584' ' ' LEU . 41.0 t 42.2 70.61 0.27 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.728 0.299 . . . . 0.0 111.257 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 48.3 t . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.066 -179.875 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.138 0 N-CA-C 112.529 -0.229 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' SER . . . . . 0.48 ' HB2' ' HD3' ' A' ' 538' ' ' PRO . 73.2 m -76.83 -51.44 2.23 Favored Pre-proline 0 CA--C 1.534 0.348 0 N-CA-C 111.328 0.121 . . . . 0.0 111.328 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' PRO . . . . . 0.48 ' HD3' ' HB2' ' A' ' 537' ' ' SER . 87.0 Cg_endo -79.03 70.15 7.62 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.195 1.93 . . . . 0.0 112.399 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -45.98 120.43 2.71 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.158 0.504 . . . . 0.0 111.816 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -99.2 1.51 44.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.702 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -72.22 -56.0 6.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.711 -175.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -127.38 153.08 77.17 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.739 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . 0.595 ' HA ' HD11 ' A' ' 566' ' ' LEU . 79.1 Cg_endo -78.02 12.78 1.9 Allowed 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.727 2.284 . . . . 0.0 112.696 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 544' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -67.4 -43.58 80.94 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 545' ' ' VAL . . . . . 0.705 ' O ' ' HG2' ' A' ' 546' ' ' ARG . 28.4 t -76.09 -32.36 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 114.53 -1.213 . . . . 0.0 108.003 177.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 546' ' ' ARG . . . . . 0.705 ' HG2' ' O ' ' A' ' 545' ' ' VAL . 2.2 ptt180 49.34 52.0 15.27 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.367 178.295 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 547' ' ' PHE . . . . . 0.546 ' O ' ' N ' ' A' ' 549' ' ' GLN . 0.1 OUTLIER 60.38 18.63 8.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.043 179.02 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 548' ' ' GLN . . . . . 0.69 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.8 pt20 28.29 -76.17 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 177.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 549' ' ' GLN . . . . . 0.69 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 12.4 mm100 -72.21 -50.81 24.59 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.559 0.695 . . . . 0.0 110.897 -178.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 550' ' ' GLN . . . . . 0.535 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 10.9 mp0 -53.93 -42.18 68.54 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 551' ' ' LEU . . . . . 0.598 HD21 ' HE ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -56.5 -40.84 75.65 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.24 176.167 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . 0.582 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 14.3 tt0 -55.4 -32.54 62.73 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.443 -179.091 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . 0.495 ' HB3' HG22 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -74.28 -58.18 3.46 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.293 179.347 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . 0.557 HD12 HD22 ' A' ' 569' ' ' LEU . 7.9 mt -55.81 -29.85 60.41 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.485 177.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 44.0 t -70.26 -39.36 75.04 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.26 -35.14 62.2 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.467 -0.788 . . . . 0.0 113.084 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 557' ' ' MET . . . . . 0.401 ' SD ' HD13 ' A' ' 580' ' ' ILE . 10.8 mtp -97.97 21.37 10.76 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.006 0.821 . . . . 0.0 110.801 179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 119.53 -118.49 3.96 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.751 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 28.39 108.35 0.0 OUTLIER 'General case' 0 C--O 1.232 0.17 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.5 12.38 29.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 113.91 -1.495 . . . . 0.0 108.86 178.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -97.78 109.34 22.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.684 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 562' ' ' ARG . . . . . 0.592 ' HB3' ' HD2' ' A' ' 546' ' ' ARG . 27.0 mmt180 -59.33 -61.8 2.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.158 -178.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -35.52 64.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.214 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -77.58 -25.73 50.2 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -177.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . 0.533 ' O ' HD22 ' A' ' 569' ' ' LEU . 78.0 m-20 -71.53 -55.62 7.48 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.441 -0.504 . . . . 0.0 109.929 -179.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.595 HD11 ' HA ' ' A' ' 543' ' ' PRO . 0.3 OUTLIER -55.98 -46.0 78.78 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.248 -179.567 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 567' ' ' GLN . . . . . 0.57 HE21 ' HA ' ' A' ' 567' ' ' GLN . 0.0 OUTLIER -61.21 -42.21 98.19 Favored 'General case' 0 CA--C 1.504 -0.826 0 C-N-CA 119.359 -0.936 . . . . 0.0 112.93 -178.209 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 568' ' ' ALA . . . . . 0.606 ' HB2' ' HB2' ' A' ' 579' ' ' ALA . . . -62.12 -28.41 69.62 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 118.857 -1.137 . . . . 0.0 108.295 177.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . 0.57 HD13 HD11 ' A' ' 576' ' ' ILE . 3.0 mm? -73.11 -42.97 62.36 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 41.5 mm -72.55 -36.97 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 571' ' ' ALA . . . . . 0.466 ' HB1' HH12 ' A' ' 582' ' ' ARG . . . -57.03 -32.32 66.06 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.959 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 33.9 p -100.18 -38.56 8.46 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.402 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 94.15 27.74 11.78 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.006 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 127.9 -31.78 3.62 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.419 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 575' ' ' ASP . . . . . 0.402 ' HB3' ' HB3' ' A' ' 578' ' ' ALA . 6.9 t0 -75.48 77.46 2.52 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.629 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.6 OUTLIER -63.95 -37.25 79.28 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.811 0 CA-C-N 114.775 -1.102 . . . . 0.0 111.243 -176.598 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 577' ' ' ASN . . . . . 0.556 ' HA ' HG13 ' A' ' 580' ' ' ILE . 7.8 m-80 -63.97 -42.37 97.27 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 124.207 0.942 . . . . 0.0 108.848 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 578' ' ' ALA . . . . . 0.408 ' O ' ' HD2' ' A' ' 582' ' ' ARG . . . -64.41 -39.5 93.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 113.969 -1.469 . . . . 0.0 107.605 177.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . 0.676 ' HA ' ' HD3' ' A' ' 582' ' ' ARG . . . -64.12 -35.43 80.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 114.4 -1.273 . . . . 0.0 110.503 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 580' ' ' ILE . . . . . 0.629 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.4 mt -63.4 -37.16 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 CA-C-O 121.205 0.526 . . . . 0.0 110.124 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -66.63 -44.4 82.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.326 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 582' ' ' ARG . . . . . 0.676 ' HD3' ' HA ' ' A' ' 579' ' ' ALA . 0.0 OUTLIER -80.46 -41.07 25.06 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.581 -0.447 . . . . 0.0 111.339 -178.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 583' ' ' LEU . . . . . 0.452 HD22 HD11 ' A' ' 554' ' ' LEU . 12.8 tp -58.07 -42.04 84.7 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.703 -178.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 584' ' ' LEU . . . . . 0.496 ' HB3' ' O ' ' A' ' 580' ' ' ILE . 0.2 OUTLIER -85.29 -20.96 29.24 Favored 'General case' 0 N--CA 1.412 -2.349 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 177.85 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -59.56 -77.88 0.16 Allowed Glycine 0 C--N 1.339 0.703 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.566 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 51.4 m 59.06 -173.89 0.1 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.918 0.389 . . . . 0.0 111.228 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.93 -179.98 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.127 0 N-CA-C 112.508 -0.237 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 50.8 m -149.09 115.06 3.67 Favored Pre-proline 0 CA--C 1.531 0.217 0 O-C-N 122.994 -0.121 . . . . 0.0 110.816 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -68.22 159.94 51.02 Favored 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.268 1.979 . . . . 0.0 112.277 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . 0.487 ' HB3' ' HB3' ' A' ' 543' ' ' PRO . 0.3 OUTLIER 55.77 105.89 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.578 -179.817 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -93.71 -76.04 0.49 Allowed 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 119.695 -0.802 . . . . 0.0 112.718 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -83.06 -67.69 0.77 Allowed 'General case' 0 C--O 1.232 0.166 0 C-N-CA 119.672 -0.811 . . . . 0.0 112.24 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . 0.453 ' HB2' HH12 ' A' ' 546' ' ' ARG . 19.2 m120 -141.22 111.17 6.51 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.019 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . 0.543 ' HA ' ' HA ' ' A' ' 548' ' ' GLN . 68.7 Cg_endo -87.77 -9.18 5.71 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.224 1.949 . . . . 0.0 111.351 178.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 544' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -73.11 -32.56 65.03 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.037 -1.438 . . . . 0.0 112.024 -178.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 545' ' ' VAL . . . . . 0.541 ' HB ' ' NE ' ' A' ' 546' ' ' ARG . 60.5 t -85.07 -68.28 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 546' ' ' ARG . . . . . 0.676 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 0.0 OUTLIER -101.03 117.13 34.42 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -177.568 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 547' ' ' PHE . . . . . 0.567 ' HD2' HD22 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 22.95 37.37 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.224 1.564 . . . . 0.0 115.224 172.774 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 548' ' ' GLN . . . . . 0.697 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.9 pt20 28.31 -86.24 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 549' ' ' GLN . . . . . 0.697 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 25.7 mt-30 -73.33 -51.5 17.24 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.225 -177.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 550' ' ' GLN . . . . . 0.513 ' HB3' ' CD1' ' A' ' 569' ' ' LEU . 2.5 mp0 -51.36 -42.24 61.19 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-O 121.441 0.639 . . . . 0.0 110.759 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 551' ' ' LEU . . . . . 0.676 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -63.09 -39.21 94.05 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.353 177.685 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . 0.523 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 12.5 tt0 -51.78 -31.93 29.0 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.331 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . 0.543 ' HG2' HD11 ' A' ' 576' ' ' ILE . 1.7 mp0 -75.33 -58.84 3.04 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.755 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . 0.632 HD12 HD23 ' A' ' 583' ' ' LEU . 8.4 mt -55.1 -36.99 66.26 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 119.111 -1.036 . . . . 0.0 111.506 178.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 4.9 m -67.92 -37.34 81.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -53.97 -34.89 61.01 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.716 -0.675 . . . . 0.0 112.803 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 557' ' ' MET . . . . . 0.535 ' HG3' HG22 ' A' ' 580' ' ' ILE . 40.7 mmm -83.28 28.39 0.53 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.08 0.855 . . . . 0.0 111.786 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 74.44 40.84 38.66 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 115.361 0.904 . . . . 0.0 115.361 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -113.33 134.19 54.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 117.551 0.676 . . . . 0.0 109.943 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 93.5 mt -111.51 -1.04 15.99 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -178.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . 0.632 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 0.2 OUTLIER -81.75 102.64 10.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.148 0.499 . . . . 0.0 110.277 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 562' ' ' ARG . . . . . 0.589 ' HB3' ' NE ' ' A' ' 546' ' ' ARG . 18.2 mmt180 -57.94 -70.97 0.12 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.87 -178.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -49.41 -33.75 14.68 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.983 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 564' ' ' ALA . . . . . 0.632 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -76.03 -23.82 55.16 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . 0.563 ' O ' HD21 ' A' ' 569' ' ' LEU . 86.1 m-20 -79.56 -51.0 9.86 Favored 'General case' 0 CA--C 1.512 -0.49 0 C-N-CA 120.551 -0.459 . . . . 0.0 110.268 -178.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.61 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.4 OUTLIER -58.57 -43.86 89.56 Favored 'General case' 0 N--CA 1.424 -1.728 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.232 -178.702 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -66.13 -43.48 87.0 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.796 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 568' ' ' ALA . . . . . 0.44 ' HB1' ' HB2' ' A' ' 579' ' ' ALA . . . -56.99 -30.03 63.8 Favored 'General case' 0 C--N 1.312 -1.056 0 C-N-CA 118.901 -1.119 . . . . 0.0 108.031 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . 0.607 HD23 HG21 ' A' ' 576' ' ' ILE . 3.2 mm? -73.83 -46.0 47.8 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 75.5 mt -71.16 -43.43 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 CA-C-O 121.435 0.636 . . . . 0.0 109.348 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -57.51 -24.04 53.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.752 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 572' ' ' THR . . . . . 0.475 HG21 ' NH2' ' A' ' 582' ' ' ARG . 35.1 p -100.66 -37.58 8.69 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 120.217 -0.593 . . . . 0.0 109.857 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 92.75 30.56 9.49 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.896 -0.593 . . . . 0.0 113.682 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 119.41 -29.85 5.99 Favored Glycine 0 C--O 1.228 -0.262 0 C-N-CA 120.361 -0.923 . . . . 0.0 112.624 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 575' ' ' ASP . . . . . 0.471 ' HB3' ' HB2' ' A' ' 578' ' ' ALA . 1.2 t0 -72.65 82.73 1.14 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 178.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.615 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -71.81 -34.92 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.705 0 CA-C-N 115.243 -0.89 . . . . 0.0 111.204 -176.874 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 577' ' ' ASN . . . . . 0.635 ' HA ' HG13 ' A' ' 580' ' ' ILE . 9.6 m-80 -64.79 -45.15 87.52 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 122.121 0.962 . . . . 0.0 108.544 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 578' ' ' ALA . . . . . 0.471 ' HB2' ' HB3' ' A' ' 575' ' ' ASP . . . -63.14 -31.58 72.75 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 113.6 -1.637 . . . . 0.0 107.792 177.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . 0.44 ' HB2' ' HB1' ' A' ' 568' ' ' ALA . . . -75.61 -30.39 59.54 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.472 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 580' ' ' ILE . . . . . 0.635 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.7 mt -66.46 -49.62 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-O 121.383 0.611 . . . . 0.0 110.703 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . 0.632 ' HA ' HD23 ' A' ' 584' ' ' LEU . 41.5 tt0 -67.64 -33.75 75.58 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.443 -179.221 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 582' ' ' ARG . . . . . 0.475 ' NH2' HG21 ' A' ' 572' ' ' THR . 0.5 OUTLIER -76.61 -36.1 57.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.583 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 583' ' ' LEU . . . . . 0.632 HD23 HD12 ' A' ' 554' ' ' LEU . 7.9 tp -68.9 -35.32 76.72 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.188 -178.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 584' ' ' LEU . . . . . 0.632 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER -79.26 -18.77 52.12 Favored 'General case' 0 N--CA 1.415 -2.211 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.536 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 168.49 146.89 5.15 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 115.198 -0.91 . . . . 0.0 112.927 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.1 t -76.51 -35.2 58.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.854 0.359 . . . . 0.0 110.798 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 62.2 p . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.344 -0.836 . . . . 0.0 110.881 179.91 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 81.1 p -110.26 122.49 38.53 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.338 0.113 . . . . 0.0 110.838 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -77.77 73.63 5.58 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.266 1.978 . . . . 0.0 112.274 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . 0.449 ' HB2' ' HG2' ' A' ' 544' ' ' GLU . 9.3 pt-20 -154.3 -52.19 0.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.884 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -50.77 -20.46 1.27 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.509 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -74.02 -30.64 62.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.932 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . 0.599 ' HB3' ' HD2' ' A' ' 543' ' ' PRO . 1.2 m120 -90.32 -170.24 0.24 Allowed Pre-proline 0 CA--C 1.54 0.582 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.585 -178.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . 0.599 ' HD2' ' HB3' ' A' ' 542' ' ' ASN . 26.5 Cg_exo -38.82 -12.19 0.02 OUTLIER 'Trans proline' 0 C--N 1.369 1.642 0 C-N-CA 123.025 2.484 . . . . 0.0 114.705 179.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 544' ' ' GLU . . . . . 0.538 ' N ' ' O ' ' A' ' 542' ' ' ASN . 0.9 OUTLIER -59.1 -19.54 45.39 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 122.388 1.09 . . . . 0.0 108.095 176.686 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 545' ' ' VAL . . . . . 0.524 ' O ' ' HB2' ' A' ' 546' ' ' ARG . 74.1 t -57.62 -29.59 34.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 176.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 546' ' ' ARG . . . . . 0.684 ' HB3' ' HB2' ' A' ' 551' ' ' LEU . 11.3 mmt180 76.73 42.8 0.14 Allowed 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 111.342 -2.663 . . . . 0.0 114.007 176.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 547' ' ' PHE . . . . . 0.569 ' HB2' HD12 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 64.1 31.01 13.7 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 117.919 -1.513 . . . . 0.0 109.085 178.076 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 548' ' ' GLN . . . . . 0.415 ' HG3' HG11 ' A' ' 545' ' ' VAL . 4.4 mt-30 30.92 -84.48 0.0 OUTLIER 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.64 -1.164 . . . . 0.0 113.77 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 549' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 547' ' ' PHE . 15.2 mm100 -73.32 -50.68 20.78 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.761 -176.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 550' ' ' GLN . . . . . 0.551 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 6.8 mp0 -49.23 -35.01 16.22 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.109 178.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 551' ' ' LEU . . . . . 0.684 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -65.65 -47.0 77.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.898 177.413 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . 0.569 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 6.2 tp10 -53.4 -32.71 50.8 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.821 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . 0.633 ' HB3' HG22 ' A' ' 576' ' ' ILE . 46.8 mt-30 -71.72 -58.29 3.61 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . 0.59 HD13 HD22 ' A' ' 583' ' ' LEU . 8.2 mt -60.38 -28.61 68.35 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 119.241 -0.984 . . . . 0.0 109.806 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 8.0 m -70.09 -39.5 75.54 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.483 ' C ' ' H ' ' A' ' 558' ' ' GLY . . . -55.6 -26.31 43.23 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.831 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 557' ' ' MET . . . . . 0.563 ' HG3' HD12 ' A' ' 580' ' ' ILE . 88.9 mmm -81.53 31.34 0.35 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.578 0.704 . . . . 0.0 110.419 178.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . 0.483 ' H ' ' C ' ' A' ' 556' ' ' ALA . . . 64.96 33.33 86.96 Favored Glycine 0 CA--C 1.522 0.498 0 CA-C-N 114.578 -1.192 . . . . 0.0 113.752 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -111.55 141.71 44.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.951 0.375 . . . . 0.0 110.284 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . 0.447 HD12 ' N ' ' A' ' 561' ' ' ASN . 3.8 pp -117.17 -34.69 4.28 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.446 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . 0.447 ' N ' HD12 ' A' ' 560' ' ' LEU . 45.0 t-20 -51.36 95.36 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.054 0.454 . . . . 0.0 111.232 -179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 562' ' ' ARG . . . . . 0.539 ' HB3' ' HE ' ' A' ' 546' ' ' ARG . 14.6 mmt180 -55.78 -41.88 74.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.467 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -47.31 -51.29 19.69 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.886 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.5 -24.71 45.7 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.11 0.481 . . . . 0.0 111.016 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -59.89 -58.49 8.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.063 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.639 ' HB2' ' HA ' ' A' ' 546' ' ' ARG . 1.1 tp -67.13 -33.78 76.18 Favored 'General case' 0 N--CA 1.423 -1.798 0 O-C-N 122.291 -0.256 . . . . 0.0 110.837 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -70.56 -42.11 71.57 Favored 'General case' 0 CA--C 1.505 -0.782 0 C-N-CA 119.445 -0.902 . . . . 0.0 113.174 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 568' ' ' ALA . . . . . 0.522 ' HB1' ' HB2' ' A' ' 579' ' ' ALA . . . -64.92 -27.11 68.63 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . 0.473 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 2.9 mm? -71.24 -53.23 15.09 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.545 -178.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 69.3 mt -70.58 -36.43 65.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.059 0.457 . . . . 0.0 110.394 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -64.2 -23.99 67.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.46 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 572' ' ' THR . . . . . 0.623 HG22 HH21 ' A' ' 582' ' ' ARG . 68.6 p -105.16 -40.63 5.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 119.764 -0.775 . . . . 0.0 110.512 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 98.11 43.48 2.8 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.526 -0.845 . . . . 0.0 113.59 176.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 574' ' ' GLY . . . . . 0.616 ' O ' HG12 ' A' ' 576' ' ' ILE . . . 107.7 -32.83 6.77 Favored Glycine 0 C--O 1.227 -0.282 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.452 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -65.16 90.6 0.09 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.633 HG22 ' HB3' ' A' ' 553' ' ' GLN . 1.8 mm -70.56 -34.48 57.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.895 -177.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 577' ' ' ASN . . . . . 0.644 ' HA ' HG13 ' A' ' 580' ' ' ILE . 1.0 OUTLIER -67.29 -50.6 59.6 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.002 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -59.24 -30.59 68.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 113.99 -1.459 . . . . 0.0 107.644 177.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . 0.523 ' HB2' HD12 ' A' ' 554' ' ' LEU . . . -75.28 -30.54 60.46 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.122 -1.399 . . . . 0.0 111.533 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 580' ' ' ILE . . . . . 0.644 HG13 ' HA ' ' A' ' 577' ' ' ASN . 4.4 mt -65.97 -46.33 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-O 121.325 0.583 . . . . 0.0 110.574 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . 0.562 ' HA ' HD23 ' A' ' 584' ' ' LEU . 28.6 mm-40 -68.07 -36.56 80.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.815 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 582' ' ' ARG . . . . . 0.623 HH21 HG22 ' A' ' 572' ' ' THR . 1.9 ttp180 -76.43 -34.53 58.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.466 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 583' ' ' LEU . . . . . 0.59 HD22 HD13 ' A' ' 554' ' ' LEU . 6.8 tp -70.45 -33.01 70.81 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.87 -179.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 584' ' ' LEU . . . . . 0.676 ' HG ' ' H ' ' A' ' 586' ' ' SER . 0.2 OUTLIER -82.99 -18.65 39.12 Favored 'General case' 0 N--CA 1.415 -2.208 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 80.54 -12.45 33.82 Favored Glycine 0 C--N 1.337 0.609 0 CA-C-N 115.286 -0.87 . . . . 0.0 113.199 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 586' ' ' SER . . . . . 0.676 ' H ' ' HG ' ' A' ' 584' ' ' LEU . 48.9 m 64.18 1.3 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.577 0.227 . . . . 0.0 111.471 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 47.5 t . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.934 -179.952 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 112.593 -0.203 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 74.3 p -158.88 81.61 2.68 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.647 0.26 . . . . 0.0 110.924 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.25 81.5 0.93 Allowed 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.477 2.118 . . . . 0.0 112.447 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -123.75 -45.47 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.308 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -64.48 -62.91 1.3 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.932 0.396 . . . . 0.0 110.552 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -56.82 -45.43 82.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.371 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . 0.448 HD21 ' H ' ' A' ' 544' ' ' GLU . 2.7 t30 -55.81 138.41 70.94 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.756 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . 0.488 ' HA ' ' CD1' ' A' ' 566' ' ' LEU . 79.3 Cg_endo -89.95 -3.32 5.5 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.83 2.353 . . . . 0.0 113.981 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 544' ' ' GLU . . . . . 0.448 ' H ' HD21 ' A' ' 542' ' ' ASN . 13.5 mm-40 -66.9 -40.47 87.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.385 . . . . 0.0 110.622 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 545' ' ' VAL . . . . . . . . . . . . . 66.3 t -62.68 -45.77 98.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 546' ' ' ARG . . . . . 0.776 HH11 ' HG3' ' A' ' 546' ' ' ARG . 0.0 OUTLIER 78.14 33.77 0.32 Allowed 'General case' 0 N--CA 1.424 -1.728 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 178.342 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 547' ' ' PHE . . . . . 0.558 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.76 31.41 7.48 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 119.419 -0.912 . . . . 0.0 111.533 177.918 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 548' ' ' GLN . . . . . 0.448 ' O ' ' HG3' ' A' ' 552' ' ' GLU . 6.8 mt-30 29.15 -82.31 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.499 1.12 . . . . 0.0 113.894 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 549' ' ' GLN . . . . . 0.476 ' N ' ' O ' ' A' ' 547' ' ' PHE . 29.6 mm-40 -72.58 -51.35 20.16 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.839 -177.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 550' ' ' GLN . . . . . 0.558 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 13.2 mp0 -50.88 -38.95 52.71 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.149 0.976 . . . . 0.0 108.538 178.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 551' ' ' LEU . . . . . 0.772 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -59.69 -45.56 91.73 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 114.089 -1.414 . . . . 0.0 109.707 175.487 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . 0.587 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 57.3 mt-10 -52.82 -32.73 45.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.117 -178.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . 0.495 ' NE2' ' HA ' ' A' ' 550' ' ' GLN . 0.5 OUTLIER -76.09 -59.21 2.86 Favored 'General case' 0 C--O 1.245 0.859 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -179.836 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . 0.624 HD13 HD23 ' A' ' 583' ' ' LEU . 14.4 mt -63.28 -28.97 70.39 Favored 'General case' 0 C--N 1.346 0.449 0 C-N-CA 118.591 -1.244 . . . . 0.0 110.234 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 555' ' ' SER . . . . . 0.678 ' HB2' HH22 ' A' ' 546' ' ' ARG . 47.2 t -70.38 -38.19 74.68 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 177.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 552' ' ' GLU . . . -55.47 -26.38 42.04 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.795 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 557' ' ' MET . . . . . 0.486 ' HG3' HD12 ' A' ' 580' ' ' ILE . 0.0 OUTLIER -86.22 27.53 0.91 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.369 179.002 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 43.09 43.19 5.52 Favored Glycine 0 CA--C 1.523 0.535 0 CA-C-N 115.014 -0.994 . . . . 0.0 113.27 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 559' ' ' PHE . . . . . 0.445 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 1.9 m-85 -77.18 -40.48 45.15 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 27.7 mt 66.19 8.12 5.32 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 178.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 42.5 t-20 -110.97 82.5 1.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.626 0.25 . . . . 0.0 110.519 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 562' ' ' ARG . . . . . 0.495 ' HD3' HH12 ' A' ' 546' ' ' ARG . 19.6 mmt180 -57.05 -31.96 65.72 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.164 0.506 . . . . 0.0 111.443 -178.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.33 -52.67 60.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.56 -179.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -79.52 -25.38 41.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.423 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . 0.762 HD21 ' NH1' ' A' ' 546' ' ' ARG . 81.1 m-20 -60.23 -59.5 5.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.988 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.529 HD22 ' HD2' ' A' ' 547' ' ' PHE . 0.3 OUTLIER -66.12 -30.65 71.18 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.502 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -71.12 -33.06 69.77 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 119.23 -0.988 . . . . 0.0 111.642 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 568' ' ' ALA . . . . . 0.573 ' HB1' ' HB3' ' A' ' 579' ' ' ALA . . . -71.51 -28.47 63.92 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 177.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . 0.527 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.3 mm? -72.13 -53.52 12.48 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.975 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 90.0 mt -66.51 -38.51 81.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.552 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -70.42 -17.48 63.01 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.6 p -105.4 -40.87 5.67 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.026 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 92.84 42.1 4.51 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.886 176.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 113.14 -34.94 4.82 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.413 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.17 87.82 0.8 Allowed 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.58 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -77.25 -26.84 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.17 -176.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 577' ' ' ASN . . . . . 0.702 ' HA ' HG13 ' A' ' 580' ' ' ILE . 14.7 m-80 -68.53 -53.7 21.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -58.77 -29.65 66.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.053 -1.43 . . . . 0.0 107.632 177.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . 0.573 ' HB3' ' HB1' ' A' ' 568' ' ' ALA . . . -75.06 -27.64 60.06 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 114.121 -1.4 . . . . 0.0 110.934 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 580' ' ' ILE . . . . . 0.702 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.5 mt -68.74 -45.26 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.193 0.52 . . . . 0.0 110.398 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . 0.69 ' HA ' HD23 ' A' ' 584' ' ' LEU . 36.1 tt0 -68.32 -37.52 80.66 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.814 -178.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 582' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 582' ' ' ARG . 0.0 OUTLIER -76.26 -31.75 58.46 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.965 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 583' ' ' LEU . . . . . 0.624 HD23 HD13 ' A' ' 554' ' ' LEU . 7.5 tp -71.23 -25.67 62.59 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-O 121.306 0.574 . . . . 0.0 109.705 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 584' ' ' LEU . . . . . 0.69 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.1 OUTLIER -86.07 -27.05 24.97 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.597 -179.78 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 130.18 -135.51 8.38 Favored Glycine 0 C--N 1.338 0.669 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.671 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 45.6 t -153.53 -0.77 0.23 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.868 0.366 . . . . 0.0 110.805 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.881 -179.994 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 112.477 -0.249 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 48.3 t 57.03 70.33 1.41 Allowed Pre-proline 0 C--N 1.331 -0.22 0 CA-C-O 120.566 0.222 . . . . 0.0 111.214 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -64.22 121.3 8.89 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.589 2.193 . . . . 0.0 111.918 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -121.68 -45.63 2.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.582 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -95.85 -13.87 23.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.835 0.35 . . . . 0.0 111.123 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -57.92 -44.07 86.65 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.37 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -52.78 148.73 12.74 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.392 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . 0.406 ' HA ' HD12 ' A' ' 566' ' ' LEU . 57.6 Cg_endo -71.51 -8.31 22.99 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.746 2.297 . . . . 0.0 112.542 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 544' ' ' GLU . . . . . 0.527 ' HG3' ' H ' ' A' ' 545' ' ' VAL . 7.2 pt-20 -72.36 -54.05 10.56 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 545' ' ' VAL . . . . . 0.527 ' H ' ' HG3' ' A' ' 544' ' ' GLU . 64.3 t -66.81 -39.05 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 177.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 546' ' ' ARG . . . . . 0.807 HH11 ' HG3' ' A' ' 546' ' ' ARG . 0.0 OUTLIER 73.09 40.26 0.56 Allowed 'General case' 0 N--CA 1.422 -1.857 0 CA-C-N 114.129 -1.396 . . . . 0.0 113.024 178.232 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 547' ' ' PHE . . . . . 0.518 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 65.92 29.94 10.07 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.134 178.196 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 548' ' ' GLN . . . . . 0.42 ' H ' HG12 ' A' ' 545' ' ' VAL . 0.0 OUTLIER 30.4 -83.32 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 124.672 1.189 . . . . 0.0 113.953 179.428 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 549' ' ' GLN . . . . . 0.45 ' N ' ' O ' ' A' ' 547' ' ' PHE . 21.6 mt-30 -72.19 -50.99 23.25 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.221 -177.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 550' ' ' GLN . . . . . 0.746 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 0.9 OUTLIER -50.87 -33.05 22.3 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 122.579 1.181 . . . . 0.0 108.501 177.819 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 551' ' ' LEU . . . . . 0.767 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -65.3 -45.08 85.78 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.767 175.488 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . 0.551 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 24.4 mm-40 -53.81 -37.76 63.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.136 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . 0.753 HE22 ' HG ' ' A' ' 554' ' ' LEU . 3.5 pp0? -72.88 -56.71 4.8 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 120.336 -0.546 . . . . 0.0 112.047 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . 0.753 ' HG ' HE22 ' A' ' 553' ' ' GLN . 11.5 mt -58.69 -29.71 66.84 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 118.359 -1.336 . . . . 0.0 110.087 178.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 47.2 t -68.95 -40.05 79.18 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -56.66 -27.38 58.49 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.982 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 95.6 mmm -89.94 21.97 3.39 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.708 0.766 . . . . 0.0 109.102 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 47.84 36.79 14.22 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 114.205 -1.361 . . . . 0.0 113.363 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 559' ' ' PHE . . . . . 0.493 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 0.3 OUTLIER -61.65 -42.99 99.67 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.546 -0.461 . . . . 0.0 111.672 179.351 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 63.2 mt 63.22 1.94 1.02 Allowed 'General case' 0 C--O 1.232 0.146 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -108.04 85.55 2.14 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 562' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -56.05 -50.76 70.06 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.78 -178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -47.4 -51.36 20.12 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.271 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.94 -25.22 43.62 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.279 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . 0.755 HD21 ' NH1' ' A' ' 546' ' ' ARG . 89.3 m-20 -60.44 -59.74 4.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.565 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.543 HD12 ' HA ' ' A' ' 546' ' ' ARG . 2.1 tp -62.04 -29.49 70.32 Favored 'General case' 0 N--CA 1.421 -1.875 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 567' ' ' GLN . . . . . 0.48 HE21 ' HA ' ' A' ' 567' ' ' GLN . 0.1 OUTLIER -68.1 -33.98 75.54 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.171 179.099 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 568' ' ' ALA . . . . . 0.566 ' HB1' HD12 ' A' ' 554' ' ' LEU . . . -75.94 -43.34 45.38 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.809 0.338 . . . . 0.0 110.913 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . 0.746 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.9 mm? -58.99 -48.56 81.15 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.021 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 84.1 mt -71.78 -40.67 69.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.244 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 571' ' ' ALA . . . . . 0.425 ' CB ' ' O ' ' A' ' 567' ' ' GLN . . . -58.76 -19.45 40.64 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 25.3 p -114.57 -39.92 3.69 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.659 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 89.32 46.44 4.38 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.059 177.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 574' ' ' GLY . . . . . 0.575 ' O ' HG12 ' A' ' 576' ' ' ILE . . . 109.57 -26.97 13.06 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.337 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.55 86.7 0.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.61 ' O ' HG13 ' A' ' 580' ' ' ILE . 7.2 mm -68.1 -44.77 84.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.204 -176.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 577' ' ' ASN . . . . . 0.55 ' HA ' HG13 ' A' ' 580' ' ' ILE . 10.9 m-80 -67.28 -53.58 28.52 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.391 -177.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -57.85 -31.0 66.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.686 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . 0.484 ' O ' ' HB3' ' A' ' 583' ' ' LEU . . . -75.31 -29.32 60.0 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.339 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 580' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 576' ' ' ILE . 1.9 mt -69.4 -47.12 74.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-O 120.971 0.415 . . . . 0.0 111.355 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . 0.609 ' HA ' HD23 ' A' ' 584' ' ' LEU . 40.8 tt0 -69.69 -38.48 77.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.528 -178.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 582' ' ' ARG . . . . . 0.631 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -75.23 -32.15 61.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.583 -179.092 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 583' ' ' LEU . . . . . 0.631 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 8.9 tp -71.69 -32.0 67.36 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.721 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 584' ' ' LEU . . . . . 0.609 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER -83.9 -15.35 48.35 Favored 'General case' 0 N--CA 1.409 -2.479 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.0 -83.96 0.13 Allowed Glycine 0 C--N 1.337 0.599 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.565 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 35.2 t -65.93 174.61 2.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.764 0.316 . . . . 0.0 110.976 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 46.7 t . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.794 -179.981 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 112.559 -0.216 . . . . 0.0 112.559 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' SER . . . . . 0.578 ' HB2' ' HD3' ' A' ' 538' ' ' PRO . 69.3 m -65.97 -49.78 55.88 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' PRO . . . . . 0.578 ' HD3' ' HB2' ' A' ' 537' ' ' SER . 37.8 Cg_exo -60.99 95.09 0.11 Allowed 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.049 1.833 . . . . 0.0 112.109 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -50.31 78.16 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.315 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' PHE . . . . . 0.518 ' N ' ' O ' ' A' ' 538' ' ' PRO . 52.2 p90 -69.77 -6.07 29.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.717 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -56.16 -45.81 79.54 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 17.2 p-10 -133.05 75.31 72.06 Favored Pre-proline 0 C--N 1.331 -0.212 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . 0.464 ' O ' ' HG2' ' A' ' 546' ' ' ARG . 96.3 Cg_endo -98.13 -9.79 0.55 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 123.331 2.687 . . . . 0.0 111.642 178.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 544' ' ' GLU . . . . . 0.539 ' HG3' ' H ' ' A' ' 545' ' ' VAL . 7.0 pt-20 -74.81 -55.13 6.14 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.819 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 545' ' ' VAL . . . . . 0.555 HG11 ' HG3' ' A' ' 548' ' ' GLN . 89.2 t -65.24 -44.02 95.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-N 115.285 -0.871 . . . . 0.0 108.999 178.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 546' ' ' ARG . . . . . 0.657 ' CZ ' ' HB2' ' A' ' 565' ' ' ASN . 0.0 OUTLIER 59.56 40.04 20.8 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.736 -179.983 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 547' ' ' PHE . . . . . 0.528 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.9 15.52 10.16 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 119.302 -0.959 . . . . 0.0 109.432 -179.183 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 548' ' ' GLN . . . . . 0.555 ' HG3' HG11 ' A' ' 545' ' ' VAL . 1.5 mt-30 34.69 -79.6 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.777 177.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 549' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 547' ' ' PHE . 95.5 mt-30 -72.07 -51.9 19.41 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.071 -177.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 550' ' ' GLN . . . . . 0.602 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 2.5 mp0 -52.45 -40.49 62.33 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 115.526 -0.761 . . . . 0.0 108.991 177.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 551' ' ' LEU . . . . . 0.648 ' HA ' HH22 ' A' ' 546' ' ' ARG . 0.1 OUTLIER -60.01 -45.55 92.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.138 176.813 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . 0.598 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 10.1 mm-40 -53.73 -31.8 49.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.605 -179.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . 0.561 ' HB3' HG22 ' A' ' 576' ' ' ILE . 7.0 mt-30 -75.78 -59.02 2.94 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . 0.561 HD21 HG23 ' A' ' 576' ' ' ILE . 10.9 mt -60.68 -30.37 69.88 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 119.681 1.128 . . . . 0.0 110.041 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 555' ' ' SER . . . . . 0.43 ' OG ' HD11 ' A' ' 551' ' ' LEU . 46.7 m -70.26 -42.05 72.66 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -56.48 -22.03 29.72 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.935 178.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 557' ' ' MET . . . . . 0.466 ' HE1' HD12 ' A' ' 580' ' ' ILE . 87.9 mmm -95.53 22.09 7.46 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.181 0.515 . . . . 0.0 110.408 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 55.43 46.33 80.89 Favored Glycine 0 CA--C 1.52 0.372 0 CA-C-N 115.492 -0.776 . . . . 0.0 113.318 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 559' ' ' PHE . . . . . 0.642 ' CE2' ' HG ' ' A' ' 583' ' ' LEU . 0.6 OUTLIER -65.7 -42.69 90.88 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.722 0.261 . . . . 0.0 111.473 179.475 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . 0.548 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 57.2 mt 75.42 11.35 3.37 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 176.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 41.3 t-20 -146.14 95.87 2.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.834 0.35 . . . . 0.0 110.288 178.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 562' ' ' ARG . . . . . 0.556 ' HA ' ' ND2' ' A' ' 565' ' ' ASN . 22.9 mmt180 -57.14 -58.52 7.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.89 -178.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -53.63 -33.31 54.68 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.816 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -75.71 -24.41 56.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.374 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . 0.657 ' HB2' ' CZ ' ' A' ' 546' ' ' ARG . 16.8 m-20 -70.84 -50.91 30.26 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.634 ' HB2' ' NE ' ' A' ' 546' ' ' ARG . 1.0 OUTLIER -51.73 -48.1 63.76 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -54.42 -46.23 73.16 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.735 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 568' ' ' ALA . . . . . . . . . . . . . . . -67.34 -41.66 84.84 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 111.619 0.229 . . . . 0.0 111.619 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . 0.602 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.5 mm? -63.44 -42.56 98.67 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 120.843 0.354 . . . . 0.0 111.921 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 30.7 mm -64.44 -35.13 73.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.173 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -87.53 -17.12 32.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.105 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 572' ' ' THR . . . . . 0.571 ' HB ' ' HB3' ' A' ' 575' ' ' ASP . 76.4 p -106.43 0.82 25.11 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 53.7 30.73 44.14 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.931 -0.652 . . . . 0.0 113.773 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 102.52 -2.16 49.69 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.891 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 575' ' ' ASP . . . . . 0.571 ' HB3' ' HB ' ' A' ' 572' ' ' THR . 2.6 t0 -77.75 77.73 4.26 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.604 ' O ' HG13 ' A' ' 580' ' ' ILE . 10.4 mm -58.18 -35.08 51.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.941 -177.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 577' ' ' ASN . . . . . 0.64 ' HA ' HG13 ' A' ' 580' ' ' ILE . 5.9 m-80 -67.76 -45.14 75.77 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.036 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 578' ' ' ALA . . . . . 0.493 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -61.88 -34.49 76.11 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.502 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . 0.441 ' HB1' HD12 ' A' ' 554' ' ' LEU . . . -71.83 -30.98 66.06 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.893 -1.048 . . . . 0.0 110.915 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 580' ' ' ILE . . . . . 0.64 HG13 ' HA ' ' A' ' 577' ' ' ASN . 3.5 mt -61.1 -56.82 15.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.616 0 CA-C-O 121.364 0.602 . . . . 0.0 110.839 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -65.36 -29.66 70.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.116 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 582' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -77.13 -47.64 19.87 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 583' ' ' LEU . . . . . 0.642 ' HG ' ' CE2' ' A' ' 559' ' ' PHE . 3.3 tm? -53.49 -58.04 8.56 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-O 121.212 0.529 . . . . 0.0 110.938 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 584' ' ' LEU . . . . . . . . . . . . . 3.5 mt -79.46 -3.41 46.47 Favored 'General case' 0 N--CA 1.394 -3.245 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.178 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -94.52 -99.11 1.65 Allowed Glycine 0 C--N 1.342 0.877 0 C-N-CA 120.514 -0.85 . . . . 0.0 112.711 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 32.7 m 69.71 1.49 3.42 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 122.38 0.272 . . . . 0.0 111.292 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 49.5 m . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.331 -0.842 . . . . 0.0 111.159 179.912 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.259 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' SER . . . . . 0.608 ' H ' ' HD2' ' A' ' 538' ' ' PRO . 43.4 t -162.47 -52.71 0.01 OUTLIER Pre-proline 0 CA--C 1.533 0.325 0 N-CA-C 111.238 0.088 . . . . 0.0 111.238 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' PRO . . . . . 0.608 ' HD2' ' H ' ' A' ' 537' ' ' SER . 55.4 Cg_endo -69.85 -35.42 12.43 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.885 1.723 . . . . 0.0 112.202 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 49.82 104.16 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.531 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -99.64 -7.95 25.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.886 0.374 . . . . 0.0 110.373 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -60.33 -25.99 66.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.09 -179.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' ASN . . . . . 0.621 ' HB3' ' HD2' ' A' ' 543' ' ' PRO . 0.9 OUTLIER -60.35 178.12 0.27 Allowed Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.052 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' PRO . . . . . 0.665 ' HA ' HD23 ' A' ' 551' ' ' LEU . 86.1 Cg_exo -48.27 -13.46 0.24 Allowed 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 121.894 1.729 . . . . 0.0 111.504 177.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 544' ' ' GLU . . . . . 0.547 ' H ' ' C ' ' A' ' 542' ' ' ASN . 40.3 mt-10 -53.89 -25.74 21.55 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 113.854 -1.521 . . . . 0.0 108.097 178.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 545' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 542' ' ' ASN . 77.9 t -54.53 -57.41 6.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 114.295 -1.32 . . . . 0.0 109.086 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 546' ' ' ARG . . . . . 0.708 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 10.4 mmt180 -116.95 127.2 53.98 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.461 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 547' ' ' PHE . . . . . 0.63 ' HB2' ' HG ' ' A' ' 566' ' ' LEU . 0.1 OUTLIER 32.4 37.85 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 176.712 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 548' ' ' GLN . . . . . 0.708 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 4.7 pt20 23.87 -84.12 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.299 1.04 . . . . 0.0 113.631 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 549' ' ' GLN . . . . . 0.708 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 4.5 pt20 -73.76 -50.33 21.16 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.635 -177.004 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 550' ' ' GLN . . . . . 0.722 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 1.3 mm100 -50.09 -44.09 51.76 Favored 'General case' 0 C--O 1.25 1.082 0 CA-C-O 121.654 0.74 . . . . 0.0 111.541 -178.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 551' ' ' LEU . . . . . 0.708 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -72.64 -34.27 67.18 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.6 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -52.17 -32.24 35.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 553' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 549' ' ' GLN . 1.7 mp0 -74.39 -58.53 3.23 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.02 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . 0.59 HD23 HD21 ' A' ' 583' ' ' LEU . 12.5 mt -60.38 -29.29 68.84 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 118.59 -1.244 . . . . 0.0 110.775 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 555' ' ' SER . . . . . 0.516 ' HB2' HD11 ' A' ' 551' ' ' LEU . 25.3 t -70.18 -37.4 75.13 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.498 ' C ' ' H ' ' A' ' 558' ' ' GLY . . . -55.14 -27.98 49.38 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.794 178.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 557' ' ' MET . . . . . 0.466 ' O ' ' SD ' ' A' ' 557' ' ' MET . 0.0 OUTLIER -81.73 19.51 1.06 Allowed 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 122.586 1.184 . . . . 0.0 109.111 178.642 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 558' ' ' GLY . . . . . 0.498 ' H ' ' C ' ' A' ' 556' ' ' ALA . . . 52.81 48.97 56.08 Favored Glycine 0 CA--C 1.524 0.61 0 CA-C-N 114.723 -1.126 . . . . 0.0 113.57 -178.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 559' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 560' ' ' LEU . 0.8 OUTLIER -74.86 -36.82 62.32 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 179.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 560' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 56.5 mt 74.0 3.54 4.44 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 178.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -125.6 95.54 4.48 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 562' ' ' ARG . . . . . 0.464 ' HB2' ' HE ' ' A' ' 546' ' ' ARG . 8.2 mmm180 -60.2 -63.15 1.4 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.374 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -50.17 -38.58 40.33 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.143 0.497 . . . . 0.0 111.934 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -68.73 -24.96 64.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.779 -178.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . 0.558 HD21 HD12 ' A' ' 551' ' ' LEU . 29.6 m-20 -80.26 -51.17 9.24 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 566' ' ' LEU . . . . . 0.702 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.5 OUTLIER -51.5 -36.45 44.68 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -177.925 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -68.57 -42.84 77.73 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.564 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 568' ' ' ALA . . . . . 0.614 ' HB1' ' HB2' ' A' ' 579' ' ' ALA . . . -61.53 -28.35 69.26 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.763 176.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . 0.722 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 4.3 mm? -72.54 -52.08 17.18 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.47 -178.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 89.1 mt -67.8 -39.5 82.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.175 0.512 . . . . 0.0 109.779 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -63.19 -19.64 64.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.564 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 34.6 p -108.23 -39.57 5.43 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 119.739 -0.785 . . . . 0.0 110.31 179.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 91.07 39.77 5.67 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.859 -0.686 . . . . 0.0 113.179 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 114.93 -30.18 6.99 Favored Glycine 0 C--N 1.333 0.391 0 C-N-CA 120.32 -0.943 . . . . 0.0 112.676 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -75.89 85.94 2.84 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 576' ' ' ILE . . . . . 0.584 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -73.99 -28.14 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.664 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.931 -177.244 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 577' ' ' ASN . . . . . 0.68 ' HA ' HG13 ' A' ' 580' ' ' ILE . 14.7 m-80 -68.73 -53.28 22.95 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 124.257 0.973 . . . . 0.0 108.722 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -60.08 -30.04 68.97 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.258 -1.337 . . . . 0.0 107.756 177.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . 0.614 ' HB2' ' HB1' ' A' ' 568' ' ' ALA . . . -74.25 -28.89 61.44 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.777 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 580' ' ' ILE . . . . . 0.68 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.2 mt -67.01 -42.38 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-O 121.302 0.572 . . . . 0.0 110.286 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 581' ' ' GLU . . . . . 0.548 ' HA ' HD23 ' A' ' 584' ' ' LEU . 37.7 tt0 -69.89 -40.49 75.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.826 -178.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 582' ' ' ARG . . . . . 0.663 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -76.32 -35.14 58.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.148 -178.554 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 583' ' ' LEU . . . . . 0.663 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 13.4 tp -71.45 -32.24 68.1 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-O 121.072 0.463 . . . . 0.0 110.371 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 584' ' ' LEU . . . . . 0.583 ' HB3' ' O ' ' A' ' 580' ' ' ILE . 0.2 OUTLIER -83.91 -16.87 42.7 Favored 'General case' 0 N--CA 1.41 -2.43 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.489 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -99.43 -0.68 56.78 Favored Glycine 0 C--N 1.338 0.663 0 CA-C-N 114.745 -1.116 . . . . 0.0 112.385 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 9.8 t -77.26 -157.48 0.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.58 0.229 . . . . 0.0 110.588 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 60.6 m . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.858 179.91 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 546' ' ' ARG . . . . . 0.687 ' HA ' ' HB2' ' A' ' 566' ' ' LEU . 5.8 mtm180 . . . . . 0 N--CA 1.436 -1.168 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 547' ' ' PHE . . . . . 0.676 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 63.99 18.23 11.08 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 -177.873 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 548' ' ' GLN . . . . . 0.472 ' HA ' HD23 ' A' ' 551' ' ' LEU . 3.2 mt-30 29.89 -78.7 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 113.773 -1.558 . . . . 0.0 114.133 177.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 549' ' ' GLN . . . . . 0.558 ' O ' ' HB3' ' A' ' 552' ' ' GLU . 81.3 mm-40 -71.4 -50.82 28.15 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.425 -177.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 550' ' ' GLN . . . . . 0.796 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 2.1 mm-40 -52.09 -40.67 61.58 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.088 -0.96 . . . . 0.0 108.874 178.281 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 551' ' ' LEU . . . . . 0.548 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -62.63 -40.74 97.96 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.724 177.706 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 552' ' ' GLU . . . . . 0.558 ' HB3' ' O ' ' A' ' 549' ' ' GLN . 5.1 tp10 -53.59 -32.12 49.73 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.55 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 553' ' ' GLN . . . . . 0.412 ' CB ' HG21 ' A' ' 576' ' ' ILE . 7.8 mp0 -77.39 -58.46 3.26 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 118.826 -0.607 . . . . 0.0 112.614 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.655 HD13 HD22 ' A' ' 583' ' ' LEU . 10.9 mt -57.85 -32.43 67.63 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 120.43 1.468 . . . . 0.0 110.369 178.393 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 555' ' ' SER . . . . . 0.427 ' HB2' HD12 ' A' ' 551' ' ' LEU . 44.9 t -68.9 -40.16 79.3 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -55.35 -27.17 45.51 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.503 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 557' ' ' MET . . . . . 0.715 ' HG3' HD13 ' A' ' 580' ' ' ILE . 26.5 mmm -89.31 24.98 2.03 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.898 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 75.56 39.94 33.68 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 115.416 0.926 . . . . 0.0 115.416 178.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 559' ' ' PHE . . . . . 0.498 ' HB2' ' O ' ' A' ' 554' ' ' LEU . 10.3 m-85 -104.44 126.89 51.95 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 118.189 0.995 . . . . 0.0 110.662 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 87.9 mt -96.31 -18.85 19.69 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -77.18 82.2 3.67 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 562' ' ' ARG . . . . . 0.604 ' HA ' ' ND2' ' A' ' 565' ' ' ASN . 15.6 mmt180 -59.89 -53.54 56.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.791 -177.641 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -52.33 -31.85 35.2 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.457 0.646 . . . . 0.0 110.794 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -73.47 -23.24 60.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.012 -178.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 565' ' ' ASN . . . . . 0.793 ' O ' HD23 ' A' ' 569' ' ' LEU . 14.8 m-20 -78.65 -47.8 16.32 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.687 ' HB2' ' HA ' ' A' ' 546' ' ' ARG . 0.6 OUTLIER -52.48 -47.92 66.23 Favored 'General case' 0 N--CA 1.42 -1.926 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.772 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -72.34 -38.12 68.69 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.981 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 568' ' ' ALA . . . . . 0.412 ' HB3' ' CD1' ' A' ' 554' ' ' LEU . . . -60.39 -31.89 70.79 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 118.93 -1.108 . . . . 0.0 108.424 178.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.796 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 4.0 mm? -73.84 -37.43 64.82 Favored 'General case' 0 N--CA 1.428 -1.561 0 CA-C-O 120.893 0.377 . . . . 0.0 111.818 -178.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 22.7 mm -65.43 -38.6 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.778 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -81.13 -15.53 55.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.394 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 572' ' ' THR . . . . . 0.592 HG21 ' HB2' ' A' ' 579' ' ' ALA . 39.6 p -104.86 4.59 32.23 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 47.4 32.01 7.05 Favored Glycine 0 C--N 1.337 0.585 0 N-CA-C 115.027 0.771 . . . . 0.0 115.027 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 108.1 -17.46 34.85 Favored Glycine 0 C--O 1.229 -0.178 0 C-N-CA 120.078 -1.058 . . . . 0.0 113.212 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 575' ' ' ASP . . . . . 0.479 ' HB3' ' HB3' ' A' ' 578' ' ' ALA . 3.3 m-20 -75.27 78.82 2.37 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.684 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -67.54 -33.86 64.77 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.976 -177.079 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 577' ' ' ASN . . . . . 0.57 ' HA ' HG13 ' A' ' 580' ' ' ILE . 2.9 m-20 -66.29 -46.68 76.15 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 124.334 1.021 . . . . 0.0 108.697 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 578' ' ' ALA . . . . . 0.479 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -62.55 -31.04 71.76 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.981 -1.463 . . . . 0.0 107.742 177.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 579' ' ' ALA . . . . . 0.592 ' HB2' HG21 ' A' ' 572' ' ' THR . . . -74.26 -33.9 63.44 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.271 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 580' ' ' ILE . . . . . 0.715 HD13 ' HG3' ' A' ' 557' ' ' MET . 3.7 mt -62.78 -44.02 99.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 121.444 0.64 . . . . 0.0 110.431 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 581' ' ' GLU . . . . . 0.444 ' HA ' HD23 ' A' ' 584' ' ' LEU . 39.7 mt-10 -68.94 -39.17 79.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.711 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 582' ' ' ARG . . . . . . . . . . . . . 2.2 ttt85 -77.44 -40.8 42.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.406 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 583' ' ' LEU . . . . . 0.655 HD22 HD13 ' A' ' 554' ' ' LEU . 8.2 tp -62.52 -44.58 96.01 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.624 -177.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 584' ' ' LEU . . . . . 0.504 ' O ' HD12 ' A' ' 584' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.42 -1.972 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 546' ' ' ARG . . . . . 0.601 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 6.3 mtm180 . . . . . 0 N--CA 1.439 -0.98 0 CA-C-O 120.96 0.41 . . . . 0.0 110.284 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 547' ' ' PHE . . . . . 0.564 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 59.34 22.6 10.99 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 -178.13 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 548' ' ' GLN . . . . . 0.728 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.9 pt20 29.42 -79.16 0.0 OUTLIER 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.516 1.527 . . . . 0.0 114.325 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 549' ' ' GLN . . . . . 0.728 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 97.1 mt-30 -71.7 -49.84 35.79 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.752 0.787 . . . . 0.0 111.006 -177.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 550' ' ' GLN . . . . . 0.633 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 11.2 mp0 -52.28 -40.33 61.63 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.345 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 551' ' ' LEU . . . . . 0.601 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -60.22 -40.23 89.43 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.749 176.684 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 552' ' ' GLU . . . . . 0.523 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 42.1 mt-10 -53.33 -32.35 48.62 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.752 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 553' ' ' GLN . . . . . 0.454 ' CD ' HD12 ' A' ' 576' ' ' ILE . 1.7 mp0 -78.29 -59.02 2.95 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 118.925 -0.56 . . . . 0.0 112.057 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.586 HD12 HD23 ' A' ' 569' ' ' LEU . 8.1 mt -54.28 -33.02 57.75 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 120.092 1.315 . . . . 0.0 110.992 177.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 555' ' ' SER . . . . . 0.418 ' HB2' HD12 ' A' ' 551' ' ' LEU . 48.4 t -69.91 -39.8 75.99 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.35 -33.46 59.09 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 43.1 mmm -97.58 22.09 9.42 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.177 0.898 . . . . 0.0 111.077 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 558' ' ' GLY . . . . . 0.413 ' O ' ' O ' ' A' ' 559' ' ' PHE . . . 117.14 -118.85 4.26 Favored Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 559' ' ' PHE . . . . . 0.449 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 90.4 m-85 29.85 112.01 0.0 OUTLIER 'General case' 0 C--O 1.232 0.139 0 N-CA-C 116.018 1.859 . . . . 0.0 116.018 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 68.3 mt -107.83 8.92 28.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.533 178.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.578 ' HB2' ' HB3' ' A' ' 564' ' ' ALA . 0.3 OUTLIER -87.9 105.75 17.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.136 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 562' ' ' ARG . . . . . 0.569 ' HD2' ' HD3' ' A' ' 546' ' ' ARG . 24.2 mmt180 -59.6 -68.75 0.25 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.555 -178.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -32.11 31.15 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.217 -179.149 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 564' ' ' ALA . . . . . 0.578 ' HB3' ' HB2' ' A' ' 561' ' ' ASN . . . -76.76 -24.72 52.96 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -177.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 565' ' ' ASN . . . . . 0.599 ' O ' HD23 ' A' ' 569' ' ' LEU . 86.1 m-20 -78.68 -49.84 12.45 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 120.816 0.341 . . . . 0.0 110.61 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.541 HD12 ' N ' ' A' ' 547' ' ' PHE . 1.1 tp -57.31 -45.77 83.88 Favored 'General case' 0 N--CA 1.421 -1.883 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.139 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -71.94 -40.22 68.88 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 568' ' ' ALA . . . . . 0.582 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -57.29 -30.32 64.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.21 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.633 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.3 mm? -72.68 -34.93 67.54 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.496 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 570' ' ' ILE . . . . . 0.425 HD13 ' HE2' ' A' ' 547' ' ' PHE . 39.1 mm -73.86 -42.1 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-O 121.474 0.654 . . . . 0.0 109.246 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -57.62 -29.21 64.34 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.726 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 32.0 p -99.37 -38.73 8.72 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.766 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 93.88 27.47 12.53 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.891 -0.671 . . . . 0.0 113.227 177.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 126.28 -33.04 3.58 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.49 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.8 79.64 1.13 Allowed 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.637 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -64.83 -36.09 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.927 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.12 -176.819 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 577' ' ' ASN . . . . . 0.587 ' HA ' HG13 ' A' ' 580' ' ' ILE . 2.8 m-20 -65.22 -40.2 93.8 Favored 'General case' 0 N--CA 1.442 -0.834 0 O-C-N 124.324 1.015 . . . . 0.0 108.501 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -66.59 -33.26 75.28 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.027 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 579' ' ' ALA . . . . . 0.526 ' HA ' ' HG2' ' A' ' 582' ' ' ARG . . . -73.51 -33.64 64.87 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.855 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 580' ' ' ILE . . . . . 0.637 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.8 mt -61.62 -48.67 87.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 121.494 0.664 . . . . 0.0 110.599 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 581' ' ' GLU . . . . . 0.567 ' HA ' HD23 ' A' ' 584' ' ' LEU . 37.4 tt0 -67.67 -36.83 81.44 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.895 -178.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 582' ' ' ARG . . . . . 0.64 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -77.87 -38.98 44.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.183 0.516 . . . . 0.0 110.647 -179.199 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 583' ' ' LEU . . . . . 0.64 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 11.2 tp -63.91 -40.41 96.43 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 123.674 0.79 . . . . 0.0 110.878 -178.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 584' ' ' LEU . . . . . 0.567 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.419 -2.021 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 546' ' ' ARG . . . . . 0.798 HH11 ' HG3' ' A' ' 546' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.421 -1.921 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 547' ' ' PHE . . . . . 0.583 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.08 28.69 10.25 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 119.322 -0.951 . . . . 0.0 109.713 178.982 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 548' ' ' GLN . . . . . 0.717 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 6.5 pt20 28.16 -81.6 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 125.004 1.322 . . . . 0.0 114.228 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 549' ' ' GLN . . . . . 0.717 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 3.7 pt20 -73.34 -50.07 23.95 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.334 -178.005 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 550' ' ' GLN . . . . . 0.702 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 11.9 mp0 -50.11 -36.26 29.01 Favored 'General case' 0 C--O 1.245 0.843 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 177.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 551' ' ' LEU . . . . . 0.749 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -62.68 -45.15 94.13 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 114.137 -1.392 . . . . 0.0 109.928 177.0 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 552' ' ' GLU . . . . . 0.59 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 14.6 mm-40 -52.87 -32.09 42.97 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.362 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 553' ' ' GLN . . . . . 0.629 ' HG3' HD12 ' A' ' 576' ' ' ILE . 3.8 mm100 -73.61 -60.24 2.34 Favored 'General case' 0 C--O 1.246 0.894 0 N-CA-C 112.424 0.528 . . . . 0.0 112.424 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.938 HD13 HD22 ' A' ' 583' ' ' LEU . 11.6 mt -62.91 -29.86 71.1 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.535 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 555' ' ' SER . . . . . 0.566 ' HB2' HD12 ' A' ' 551' ' ' LEU . 46.7 t -69.73 -38.47 76.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -55.91 -26.58 48.21 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.434 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 557' ' ' MET . . . . . 0.618 ' HG3' HD13 ' A' ' 580' ' ' ILE . 84.8 mmm -87.34 25.32 1.42 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.317 0.58 . . . . 0.0 110.138 178.725 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 44.31 44.15 7.73 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-N 114.728 -1.124 . . . . 0.0 113.633 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 559' ' ' PHE . . . . . 0.486 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 1.6 m-85 -76.11 -41.96 48.6 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 113.353 0.872 . . . . 0.0 113.353 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 23.4 mt 66.28 7.15 4.68 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 178.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -108.98 79.56 1.23 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 562' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 562' ' ' ARG . 7.1 mmt180 -58.65 -29.07 66.26 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.59 -178.244 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -65.16 -51.84 58.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.075 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.81 -25.1 44.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.253 -178.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 565' ' ' ASN . . . . . 0.485 ' O ' HD23 ' A' ' 569' ' ' LEU . 7.1 m120 -60.8 -58.02 10.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.781 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.648 HD13 ' HA ' ' A' ' 546' ' ' ARG . 2.1 tp -63.82 -30.95 71.99 Favored 'General case' 0 N--CA 1.424 -1.751 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -69.9 -32.01 70.1 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.385 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 568' ' ' ALA . . . . . 0.651 ' HB1' ' HB1' ' A' ' 579' ' ' ALA . . . -77.36 -38.91 49.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.859 0.362 . . . . 0.0 110.768 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.702 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.9 mm? -64.05 -49.56 71.87 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.224 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 83.4 mt -70.07 -39.74 77.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.259 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -67.96 -15.33 63.56 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 48.7 p -108.13 -40.89 5.07 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 119.756 -0.778 . . . . 0.0 110.324 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 94.42 43.45 3.71 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.378 -0.915 . . . . 0.0 112.652 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 110.84 -33.42 5.91 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.343 -0.932 . . . . 0.0 112.271 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.96 87.51 1.33 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.629 HD12 ' HG3' ' A' ' 553' ' ' GLN . 0.6 OUTLIER -77.62 -27.0 15.28 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.425 -176.836 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 577' ' ' ASN . . . . . 0.683 ' HA ' HG13 ' A' ' 580' ' ' ILE . 4.5 m-20 -68.84 -53.64 20.27 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -58.44 -29.87 66.49 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.249 -1.341 . . . . 0.0 107.76 176.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 579' ' ' ALA . . . . . 0.651 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -74.82 -27.44 60.29 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.12 -1.4 . . . . 0.0 110.929 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 580' ' ' ILE . . . . . 0.683 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.3 mt -69.51 -43.42 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 121.081 0.467 . . . . 0.0 110.604 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 581' ' ' GLU . . . . . 0.673 ' HA ' HD23 ' A' ' 584' ' ' LEU . 41.6 tt0 -69.49 -38.02 77.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.217 -178.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 582' ' ' ARG . . . . . 0.65 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -75.41 -32.12 60.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.497 -179.335 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 583' ' ' LEU . . . . . 0.938 HD22 HD13 ' A' ' 554' ' ' LEU . 8.1 tp -72.14 -31.89 66.41 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.79 -178.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 584' ' ' LEU . . . . . 0.673 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.408 -2.531 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 546' ' ' ARG . . . . . 0.665 ' HA ' HD12 ' A' ' 566' ' ' LEU . 2.2 ptt180 . . . . . 0 CA--C 1.513 -0.446 0 CA-C-O 121.79 0.805 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 547' ' ' PHE . . . . . 0.587 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 60.38 18.63 8.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.043 179.02 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 548' ' ' GLN . . . . . 0.717 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.8 pt20 28.29 -76.17 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 177.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 549' ' ' GLN . . . . . 0.717 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 12.4 mm100 -72.21 -50.81 24.59 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.559 0.695 . . . . 0.0 110.897 -178.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 550' ' ' GLN . . . . . 0.587 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 10.9 mp0 -53.93 -42.18 68.54 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 551' ' ' LEU . . . . . 0.659 HD22 ' CG ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -56.5 -40.84 75.65 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.24 176.167 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 552' ' ' GLU . . . . . 0.598 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 14.3 tt0 -55.4 -32.54 62.73 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.443 -179.091 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 553' ' ' GLN . . . . . 0.504 ' HB3' HG21 ' A' ' 576' ' ' ILE . 1.0 OUTLIER -74.28 -58.18 3.46 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.293 179.347 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.653 HD11 ' HB3' ' A' ' 568' ' ' ALA . 7.9 mt -55.81 -29.85 60.41 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.485 177.392 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 44.0 t -70.26 -39.36 75.04 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 553' ' ' GLN . . . -54.26 -35.14 62.2 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.467 -0.788 . . . . 0.0 113.084 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 10.8 mtp -97.97 21.37 10.76 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.006 0.821 . . . . 0.0 110.801 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 119.53 -118.49 3.96 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.751 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 559' ' ' PHE . . . . . 0.402 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 83.9 m-85 28.39 108.35 0.0 OUTLIER 'General case' 0 C--O 1.232 0.17 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.5 12.38 29.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 113.91 -1.495 . . . . 0.0 108.86 178.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.472 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 49.5 t-20 -97.78 109.34 22.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.684 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 562' ' ' ARG . . . . . 0.619 ' HB3' ' HD2' ' A' ' 546' ' ' ARG . 27.0 mmt180 -59.33 -61.8 2.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.158 -178.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -35.52 64.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.214 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 564' ' ' ALA . . . . . 0.472 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -77.58 -25.73 50.2 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -177.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 565' ' ' ASN . . . . . 0.545 ' O ' HD23 ' A' ' 569' ' ' LEU . 78.0 m-20 -71.53 -55.62 7.48 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.441 -0.504 . . . . 0.0 109.929 -179.156 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.665 HD12 ' HA ' ' A' ' 546' ' ' ARG . 0.3 OUTLIER -55.98 -46.0 78.78 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.248 -179.567 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -61.21 -42.21 98.19 Favored 'General case' 0 CA--C 1.504 -0.826 0 C-N-CA 119.359 -0.936 . . . . 0.0 112.93 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 568' ' ' ALA . . . . . 0.653 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -62.12 -28.41 69.62 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 118.857 -1.137 . . . . 0.0 108.295 177.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.64 HD11 HD13 ' A' ' 576' ' ' ILE . 3.0 mm? -73.11 -42.97 62.36 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 41.5 mm -72.55 -36.97 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 571' ' ' ALA . . . . . 0.533 ' HB1' HH12 ' A' ' 582' ' ' ARG . . . -57.03 -32.32 66.06 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.959 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 33.9 p -100.18 -38.56 8.46 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.402 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 94.15 27.74 11.78 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.006 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 127.9 -31.78 3.62 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.419 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -75.48 77.46 2.52 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.651 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.6 OUTLIER -63.95 -37.25 79.28 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.811 0 CA-C-N 114.775 -1.102 . . . . 0.0 111.243 -176.598 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 577' ' ' ASN . . . . . 0.525 ' HA ' HG13 ' A' ' 580' ' ' ILE . 7.8 m-80 -63.97 -42.37 97.27 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 124.207 0.942 . . . . 0.0 108.848 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 578' ' ' ALA . . . . . 0.436 ' O ' ' HD2' ' A' ' 582' ' ' ARG . . . -64.41 -39.5 93.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 113.969 -1.469 . . . . 0.0 107.605 177.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 579' ' ' ALA . . . . . 0.696 ' HA ' ' HD3' ' A' ' 582' ' ' ARG . . . -64.12 -35.43 80.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 114.4 -1.273 . . . . 0.0 110.503 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 580' ' ' ILE . . . . . 0.651 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.4 mt -63.4 -37.16 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 CA-C-O 121.205 0.526 . . . . 0.0 110.124 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -66.63 -44.4 82.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.326 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 582' ' ' ARG . . . . . 0.696 ' HD3' ' HA ' ' A' ' 579' ' ' ALA . 0.0 OUTLIER -80.46 -41.07 25.06 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.581 -0.447 . . . . 0.0 111.339 -178.961 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 583' ' ' LEU . . . . . 0.48 ' HB3' ' O ' ' A' ' 579' ' ' ALA . 12.8 tp -58.07 -42.04 84.7 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.703 -178.61 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 584' ' ' LEU . . . . . 0.488 ' HB3' ' O ' ' A' ' 580' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.412 -2.349 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 177.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 546' ' ' ARG . . . . . 0.774 ' HD2' HD22 ' A' ' 551' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.52 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 547' ' ' PHE . . . . . 0.627 ' HD2' HD23 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 22.95 37.37 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.224 1.564 . . . . 0.0 115.224 172.774 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 548' ' ' GLN . . . . . 0.693 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 6.4 pt20 28.31 -86.24 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 549' ' ' GLN . . . . . 0.693 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 75.6 mt-30 -73.33 -51.5 17.24 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.225 -177.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 550' ' ' GLN . . . . . 0.534 ' HB3' ' CD1' ' A' ' 569' ' ' LEU . 2.5 mp0 -51.36 -42.24 61.19 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-O 121.441 0.639 . . . . 0.0 110.759 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 551' ' ' LEU . . . . . 0.774 HD22 ' HD2' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -63.09 -39.21 94.05 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.353 177.685 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 552' ' ' GLU . . . . . 0.541 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 12.5 tt0 -51.78 -31.93 29.0 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.331 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 553' ' ' GLN . . . . . 0.56 ' HG2' HD12 ' A' ' 576' ' ' ILE . 1.1 mp0 -75.33 -58.84 3.04 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.755 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.649 HD13 HD22 ' A' ' 583' ' ' LEU . 8.4 mt -55.1 -36.99 66.26 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 119.111 -1.036 . . . . 0.0 111.506 178.459 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 4.9 m -67.92 -37.34 81.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 553' ' ' GLN . . . -53.97 -34.89 61.01 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.716 -0.675 . . . . 0.0 112.803 179.326 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 557' ' ' MET . . . . . 0.617 ' HG3' HG21 ' A' ' 580' ' ' ILE . 40.7 mmm -83.28 28.39 0.53 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.08 0.855 . . . . 0.0 111.786 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 74.44 40.84 38.66 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 115.361 0.904 . . . . 0.0 115.361 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -113.33 134.19 54.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 117.551 0.676 . . . . 0.0 109.943 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 93.5 mt -111.51 -1.04 15.99 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -178.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.716 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 11.7 t-20 -81.75 102.64 10.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.148 0.499 . . . . 0.0 110.277 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 562' ' ' ARG . . . . . 0.594 ' HB3' ' NE ' ' A' ' 546' ' ' ARG . 18.2 mmt180 -57.94 -70.97 0.12 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.87 -178.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -49.41 -33.75 14.68 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.983 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 564' ' ' ALA . . . . . 0.716 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -76.03 -23.82 55.16 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 565' ' ' ASN . . . . . 0.6 ' O ' HD23 ' A' ' 569' ' ' LEU . 86.1 m-20 -79.56 -51.0 9.86 Favored 'General case' 0 CA--C 1.512 -0.49 0 C-N-CA 120.551 -0.459 . . . . 0.0 110.268 -178.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.629 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.4 OUTLIER -58.57 -43.86 89.56 Favored 'General case' 0 N--CA 1.424 -1.728 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.232 -178.702 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -66.13 -43.48 87.0 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.796 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 568' ' ' ALA . . . . . 0.533 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -56.99 -30.03 63.8 Favored 'General case' 0 C--N 1.312 -1.056 0 C-N-CA 118.901 -1.119 . . . . 0.0 108.031 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.6 HD23 ' O ' ' A' ' 565' ' ' ASN . 3.2 mm? -73.83 -46.0 47.8 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 75.5 mt -71.16 -43.43 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 CA-C-O 121.435 0.636 . . . . 0.0 109.348 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -57.51 -24.04 53.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.752 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 572' ' ' THR . . . . . 0.484 HG22 ' NH2' ' A' ' 582' ' ' ARG . 35.1 p -100.66 -37.58 8.69 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 120.217 -0.593 . . . . 0.0 109.857 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 92.75 30.56 9.49 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.896 -0.593 . . . . 0.0 113.682 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 119.41 -29.85 5.99 Favored Glycine 0 C--O 1.228 -0.262 0 C-N-CA 120.361 -0.923 . . . . 0.0 112.624 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 575' ' ' ASP . . . . . 0.465 ' HB3' ' HB3' ' A' ' 578' ' ' ALA . 1.2 t0 -72.65 82.73 1.14 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 178.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.638 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -71.81 -34.92 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.705 0 CA-C-N 115.243 -0.89 . . . . 0.0 111.204 -176.874 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 577' ' ' ASN . . . . . 0.616 ' HA ' HG13 ' A' ' 580' ' ' ILE . 9.6 m-80 -64.79 -45.15 87.52 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 122.121 0.962 . . . . 0.0 108.544 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 578' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -63.14 -31.58 72.75 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 113.6 -1.637 . . . . 0.0 107.792 177.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -75.61 -30.39 59.54 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.472 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 580' ' ' ILE . . . . . 0.638 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.7 mt -66.46 -49.62 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-O 121.383 0.611 . . . . 0.0 110.703 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 581' ' ' GLU . . . . . 0.707 ' HA ' HD23 ' A' ' 584' ' ' LEU . 41.5 tt0 -67.64 -33.75 75.58 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.443 -179.221 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 582' ' ' ARG . . . . . 0.484 ' NH2' HG22 ' A' ' 572' ' ' THR . 0.5 OUTLIER -76.61 -36.1 57.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.583 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 583' ' ' LEU . . . . . 0.649 HD22 HD13 ' A' ' 554' ' ' LEU . 7.9 tp -68.9 -35.32 76.72 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.188 -178.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 584' ' ' LEU . . . . . 0.707 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.415 -2.211 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 546' ' ' ARG . . . . . 0.694 ' HB3' ' HB2' ' A' ' 551' ' ' LEU . 11.3 mmt180 . . . . . 0 N--CA 1.432 -1.336 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 547' ' ' PHE . . . . . 0.638 ' HB2' HD12 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 64.1 31.01 13.7 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 117.919 -1.513 . . . . 0.0 109.085 178.076 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 548' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 30.92 -84.48 0.0 OUTLIER 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.64 -1.164 . . . . 0.0 113.77 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 549' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 547' ' ' PHE . 15.2 mm100 -73.32 -50.68 20.78 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.761 -176.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 550' ' ' GLN . . . . . 0.62 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 6.8 mp0 -49.23 -35.01 16.22 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.109 178.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 551' ' ' LEU . . . . . 0.694 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -65.65 -47.0 77.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.898 177.413 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 552' ' ' GLU . . . . . 0.583 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 6.2 tp10 -53.4 -32.71 50.8 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.821 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 553' ' ' GLN . . . . . 0.653 ' HB3' HG21 ' A' ' 576' ' ' ILE . 52.7 mt-30 -71.72 -58.29 3.61 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.827 HD13 HD22 ' A' ' 583' ' ' LEU . 8.2 mt -60.38 -28.61 68.35 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 119.241 -0.984 . . . . 0.0 109.806 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 555' ' ' SER . . . . . 0.419 ' OG ' HD12 ' A' ' 551' ' ' LEU . 8.0 m -70.09 -39.5 75.54 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.437 ' C ' ' H ' ' A' ' 558' ' ' GLY . . . -55.6 -26.31 43.23 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.831 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 557' ' ' MET . . . . . 0.619 ' HG3' HD13 ' A' ' 580' ' ' ILE . 88.9 mmm -81.53 31.34 0.35 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.578 0.704 . . . . 0.0 110.419 178.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 558' ' ' GLY . . . . . 0.437 ' H ' ' C ' ' A' ' 556' ' ' ALA . . . 64.96 33.33 86.96 Favored Glycine 0 CA--C 1.522 0.498 0 CA-C-N 114.578 -1.192 . . . . 0.0 113.752 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -111.55 141.71 44.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.951 0.375 . . . . 0.0 110.284 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.453 HD12 ' N ' ' A' ' 561' ' ' ASN . 3.8 pp -117.17 -34.69 4.28 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.446 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.541 ' O ' ' ND2' ' A' ' 565' ' ' ASN . 45.0 t-20 -51.36 95.36 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.054 0.454 . . . . 0.0 111.232 -179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 562' ' ' ARG . . . . . 0.58 ' HB3' ' HE ' ' A' ' 546' ' ' ARG . 14.6 mmt180 -55.78 -41.88 74.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.467 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -47.31 -51.29 19.69 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.886 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.5 -24.71 45.7 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.11 0.481 . . . . 0.0 111.016 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 565' ' ' ASN . . . . . 0.782 ' O ' HD23 ' A' ' 569' ' ' LEU . 0.9 OUTLIER -59.89 -58.49 8.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.063 -179.497 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.642 ' HB2' ' HA ' ' A' ' 546' ' ' ARG . 1.1 tp -67.13 -33.78 76.18 Favored 'General case' 0 N--CA 1.423 -1.798 0 O-C-N 122.291 -0.256 . . . . 0.0 110.837 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -70.56 -42.11 71.57 Favored 'General case' 0 CA--C 1.505 -0.782 0 C-N-CA 119.445 -0.902 . . . . 0.0 113.174 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 568' ' ' ALA . . . . . 0.586 ' HB3' ' CD1' ' A' ' 554' ' ' LEU . . . -64.92 -27.11 68.63 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.062 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.782 HD23 ' O ' ' A' ' 565' ' ' ASN . 2.9 mm? -71.24 -53.23 15.09 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.545 -178.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 69.3 mt -70.58 -36.43 65.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.059 0.457 . . . . 0.0 110.394 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -64.2 -23.99 67.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.46 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 572' ' ' THR . . . . . 0.639 HG22 HH21 ' A' ' 582' ' ' ARG . 68.6 p -105.16 -40.63 5.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 119.764 -0.775 . . . . 0.0 110.512 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 98.11 43.48 2.8 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.526 -0.845 . . . . 0.0 113.59 176.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 574' ' ' GLY . . . . . 0.625 ' O ' HG12 ' A' ' 576' ' ' ILE . . . 107.7 -32.83 6.77 Favored Glycine 0 C--O 1.227 -0.282 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.452 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -65.16 90.6 0.09 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.659 ' O ' HG13 ' A' ' 580' ' ' ILE . 1.8 mm -70.56 -34.48 57.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.895 -177.296 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 577' ' ' ASN . . . . . 0.625 ' HA ' HG13 ' A' ' 580' ' ' ILE . 3.9 m-20 -67.29 -50.6 59.6 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.002 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -59.24 -30.59 68.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 113.99 -1.459 . . . . 0.0 107.644 177.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 579' ' ' ALA . . . . . 0.698 ' HB1' HD11 ' A' ' 554' ' ' LEU . . . -75.28 -30.54 60.46 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.122 -1.399 . . . . 0.0 111.533 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 580' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 576' ' ' ILE . 4.4 mt -65.97 -46.33 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-O 121.325 0.583 . . . . 0.0 110.574 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 581' ' ' GLU . . . . . 0.615 ' HA ' HD23 ' A' ' 584' ' ' LEU . 28.6 mm-40 -68.07 -36.56 80.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.815 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 582' ' ' ARG . . . . . 0.639 HH21 HG22 ' A' ' 572' ' ' THR . 1.9 ttp180 -76.43 -34.53 58.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.466 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 583' ' ' LEU . . . . . 0.827 HD22 HD13 ' A' ' 554' ' ' LEU . 6.8 tp -70.45 -33.01 70.81 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.87 -179.032 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 584' ' ' LEU . . . . . 0.615 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.415 -2.208 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 546' ' ' ARG . . . . . 0.806 ' HB3' ' HB2' ' A' ' 551' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.424 -1.728 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 547' ' ' PHE . . . . . 0.615 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.76 31.41 7.48 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 119.419 -0.912 . . . . 0.0 111.533 177.918 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 548' ' ' GLN . . . . . 0.468 ' HA ' HD23 ' A' ' 551' ' ' LEU . 24.4 mt-30 29.15 -82.31 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.499 1.12 . . . . 0.0 113.894 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 549' ' ' GLN . . . . . 0.476 ' N ' ' O ' ' A' ' 547' ' ' PHE . 29.6 mm-40 -72.58 -51.35 20.16 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.839 -177.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 550' ' ' GLN . . . . . 0.615 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 13.2 mp0 -50.88 -38.95 52.71 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.149 0.976 . . . . 0.0 108.538 178.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 551' ' ' LEU . . . . . 0.806 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -59.69 -45.56 91.73 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 114.089 -1.414 . . . . 0.0 109.707 175.487 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 552' ' ' GLU . . . . . 0.609 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 57.3 mt-10 -52.82 -32.73 45.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.117 -178.701 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 8.3 mp0 -76.09 -59.21 2.86 Favored 'General case' 0 C--O 1.245 0.859 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.93 HD13 HD22 ' A' ' 583' ' ' LEU . 14.4 mt -63.28 -28.97 70.39 Favored 'General case' 0 C--N 1.346 0.449 0 C-N-CA 118.591 -1.244 . . . . 0.0 110.234 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 555' ' ' SER . . . . . 0.697 ' HB2' HH22 ' A' ' 546' ' ' ARG . 47.2 t -70.38 -38.19 74.68 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 177.26 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' A' ' 552' ' ' GLU . . . -55.47 -26.38 42.04 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.795 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 557' ' ' MET . . . . . 0.485 ' HG3' HD13 ' A' ' 580' ' ' ILE . 0.0 OUTLIER -86.22 27.53 0.91 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.369 179.002 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 43.09 43.19 5.52 Favored Glycine 0 CA--C 1.523 0.535 0 CA-C-N 115.014 -0.994 . . . . 0.0 113.27 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 559' ' ' PHE . . . . . 0.466 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 1.9 m-85 -77.18 -40.48 45.15 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 27.7 mt 66.19 8.12 5.32 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 178.138 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 42.5 t-20 -110.97 82.5 1.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.626 0.25 . . . . 0.0 110.519 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 562' ' ' ARG . . . . . 0.534 ' HD3' HH12 ' A' ' 546' ' ' ARG . 19.6 mmt180 -57.05 -31.96 65.72 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.164 0.506 . . . . 0.0 111.443 -178.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.33 -52.67 60.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.56 -179.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -79.52 -25.38 41.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.423 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 565' ' ' ASN . . . . . 0.687 ' O ' HD23 ' A' ' 569' ' ' LEU . 5.4 m120 -60.23 -59.5 5.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.988 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.486 ' HB2' ' CD ' ' A' ' 546' ' ' ARG . 0.3 OUTLIER -66.12 -30.65 71.18 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.502 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -71.12 -33.06 69.77 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 119.23 -0.988 . . . . 0.0 111.642 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 568' ' ' ALA . . . . . 0.525 ' HB3' ' CD1' ' A' ' 554' ' ' LEU . . . -71.51 -28.47 63.92 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 177.376 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.687 HD23 ' O ' ' A' ' 565' ' ' ASN . 3.3 mm? -72.13 -53.52 12.48 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.975 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 90.0 mt -66.51 -38.51 81.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.552 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -70.42 -17.48 63.01 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.6 p -105.4 -40.87 5.67 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.026 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 92.84 42.1 4.51 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.886 176.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 113.14 -34.94 4.82 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.413 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.17 87.82 0.8 Allowed 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.6 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -77.25 -26.84 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.17 -176.871 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 577' ' ' ASN . . . . . 0.693 ' HA ' HG13 ' A' ' 580' ' ' ILE . 14.7 m-80 -68.53 -53.7 21.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -58.77 -29.65 66.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.053 -1.43 . . . . 0.0 107.632 177.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 579' ' ' ALA . . . . . 0.487 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -75.06 -27.64 60.06 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 114.121 -1.4 . . . . 0.0 110.934 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 580' ' ' ILE . . . . . 0.693 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.5 mt -68.74 -45.26 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.193 0.52 . . . . 0.0 110.398 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 581' ' ' GLU . . . . . 0.793 ' HA ' HD23 ' A' ' 584' ' ' LEU . 36.1 tt0 -68.32 -37.52 80.66 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.814 -178.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 582' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 582' ' ' ARG . 0.0 OUTLIER -76.26 -31.75 58.46 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.965 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 583' ' ' LEU . . . . . 0.93 HD22 HD13 ' A' ' 554' ' ' LEU . 7.5 tp -71.23 -25.67 62.59 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-O 121.306 0.574 . . . . 0.0 109.705 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 584' ' ' LEU . . . . . 0.793 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.415 -2.182 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.597 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 546' ' ' ARG . . . . . 0.827 HH11 ' HG3' ' A' ' 546' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.422 -1.857 0 N-CA-C 113.024 0.749 . . . . 0.0 113.024 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 547' ' ' PHE . . . . . 0.576 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 65.92 29.94 10.07 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.134 178.196 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 548' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 30.4 -83.32 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 124.672 1.189 . . . . 0.0 113.953 179.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 549' ' ' GLN . . . . . 0.45 ' N ' ' O ' ' A' ' 547' ' ' PHE . 95.8 mt-30 -72.19 -50.99 23.25 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.221 -177.766 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 550' ' ' GLN . . . . . 0.784 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 1.8 mp0 -50.87 -33.05 22.3 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 122.579 1.181 . . . . 0.0 108.501 177.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 551' ' ' LEU . . . . . 0.802 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -65.3 -45.08 85.78 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.767 175.488 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 552' ' ' GLU . . . . . 0.57 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 24.4 mm-40 -53.81 -37.76 63.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.136 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 553' ' ' GLN . . . . . 0.702 ' HG3' ' O ' ' A' ' 550' ' ' GLN . 0.0 OUTLIER -72.88 -56.71 4.8 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 120.336 -0.546 . . . . 0.0 112.047 -179.418 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.568 HD11 ' HB3' ' A' ' 568' ' ' ALA . 11.5 mt -58.69 -29.71 66.84 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 118.359 -1.336 . . . . 0.0 110.087 178.476 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 47.2 t -68.95 -40.05 79.18 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -56.66 -27.38 58.49 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.982 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 95.6 mmm -89.94 21.97 3.39 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.708 0.766 . . . . 0.0 109.102 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 47.84 36.79 14.22 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 114.205 -1.361 . . . . 0.0 113.363 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 559' ' ' PHE . . . . . 0.658 ' HB3' HD22 ' A' ' 565' ' ' ASN . 0.3 OUTLIER -61.65 -42.99 99.67 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.546 -0.461 . . . . 0.0 111.672 179.351 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 63.2 mt 63.22 1.94 1.02 Allowed 'General case' 0 C--O 1.232 0.146 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -108.04 85.55 2.14 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 562' ' ' ARG . . . . . 0.41 ' HG2' ' H ' ' A' ' 562' ' ' ARG . 24.7 mmt180 -56.05 -50.76 70.06 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.78 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -47.4 -51.36 20.12 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.271 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.94 -25.22 43.62 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.279 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 565' ' ' ASN . . . . . 0.658 HD22 ' HB3' ' A' ' 559' ' ' PHE . 5.7 m120 -60.44 -59.74 4.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.565 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.631 HD13 ' HA ' ' A' ' 546' ' ' ARG . 2.1 tp -62.04 -29.49 70.32 Favored 'General case' 0 N--CA 1.421 -1.875 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 567' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 571' ' ' ALA . 6.3 tp60 -68.1 -33.98 75.54 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.171 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 568' ' ' ALA . . . . . 0.568 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -75.94 -43.34 45.38 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.809 0.338 . . . . 0.0 110.913 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.784 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.9 mm? -58.99 -48.56 81.15 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.021 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 84.1 mt -71.78 -40.67 69.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.244 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 571' ' ' ALA . . . . . 0.464 ' HB2' ' O ' ' A' ' 567' ' ' GLN . . . -58.76 -19.45 40.64 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 25.3 p -114.57 -39.92 3.69 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.659 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 89.32 46.44 4.38 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.059 177.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 574' ' ' GLY . . . . . 0.58 ' O ' HG12 ' A' ' 576' ' ' ILE . . . 109.57 -26.97 13.06 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.337 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.55 86.7 0.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.245 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.627 ' O ' HG13 ' A' ' 580' ' ' ILE . 7.2 mm -68.1 -44.77 84.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.204 -176.006 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 577' ' ' ASN . . . . . 0.549 ' HA ' HG13 ' A' ' 580' ' ' ILE . 10.9 m-80 -67.28 -53.58 28.52 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.391 -177.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -57.85 -31.0 66.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.686 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 579' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 583' ' ' LEU . . . -75.31 -29.32 60.0 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.339 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 580' ' ' ILE . . . . . 0.627 HG13 ' O ' ' A' ' 576' ' ' ILE . 1.9 mt -69.4 -47.12 74.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-O 120.971 0.415 . . . . 0.0 111.355 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 581' ' ' GLU . . . . . 0.649 ' HA ' HD23 ' A' ' 584' ' ' LEU . 40.8 tt0 -69.69 -38.48 77.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.528 -178.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 582' ' ' ARG . . . . . 0.628 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -75.23 -32.15 61.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.583 -179.092 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 583' ' ' LEU . . . . . 0.628 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 8.9 tp -71.69 -32.0 67.36 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.721 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 584' ' ' LEU . . . . . 0.649 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.409 -2.479 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 546' ' ' ARG . . . . . 0.679 HH22 ' HA ' ' A' ' 551' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.41 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 547' ' ' PHE . . . . . 0.57 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.9 15.52 10.16 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 119.302 -0.959 . . . . 0.0 109.432 -179.183 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 548' ' ' GLN . . . . . 0.556 ' HA ' HD23 ' A' ' 551' ' ' LEU . 1.5 mt-30 34.69 -79.6 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.777 177.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 549' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 547' ' ' PHE . 95.5 mt-30 -72.07 -51.9 19.41 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.071 -177.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 550' ' ' GLN . . . . . 0.638 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 1.8 mp0 -52.45 -40.49 62.33 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 115.526 -0.761 . . . . 0.0 108.991 177.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 551' ' ' LEU . . . . . 0.679 ' HA ' HH22 ' A' ' 546' ' ' ARG . 0.1 OUTLIER -60.01 -45.55 92.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.138 176.813 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 552' ' ' GLU . . . . . 0.611 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 10.1 mm-40 -53.73 -31.8 49.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.605 -179.233 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 553' ' ' GLN . . . . . 0.608 ' HB3' HG21 ' A' ' 576' ' ' ILE . 45.8 mt-30 -75.78 -59.02 2.94 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.577 HD13 ' CE2' ' A' ' 559' ' ' PHE . 10.9 mt -60.68 -30.37 69.88 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 119.681 1.128 . . . . 0.0 110.041 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 555' ' ' SER . . . . . 0.482 ' OG ' HD12 ' A' ' 551' ' ' LEU . 46.7 m -70.26 -42.05 72.66 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -56.48 -22.03 29.72 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.935 178.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 87.9 mmm -95.53 22.09 7.46 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.181 0.515 . . . . 0.0 110.408 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 55.43 46.33 80.89 Favored Glycine 0 CA--C 1.52 0.372 0 CA-C-N 115.492 -0.776 . . . . 0.0 113.318 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 559' ' ' PHE . . . . . 0.651 ' CE2' ' HG ' ' A' ' 583' ' ' LEU . 0.6 OUTLIER -65.7 -42.69 90.88 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.722 0.261 . . . . 0.0 111.473 179.475 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 57.2 mt 75.42 11.35 3.37 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 176.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.432 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 41.3 t-20 -146.14 95.87 2.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.834 0.35 . . . . 0.0 110.288 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 562' ' ' ARG . . . . . 0.575 ' HA ' ' ND2' ' A' ' 565' ' ' ASN . 22.9 mmt180 -57.14 -58.52 7.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.89 -178.503 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -53.63 -33.31 54.68 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.816 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 564' ' ' ALA . . . . . 0.432 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -75.71 -24.41 56.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.374 -178.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 565' ' ' ASN . . . . . 0.679 ' HB2' ' CZ ' ' A' ' 546' ' ' ARG . 16.8 m-20 -70.84 -50.91 30.26 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.643 ' HB2' ' NE ' ' A' ' 546' ' ' ARG . 1.0 OUTLIER -51.73 -48.1 63.76 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -54.42 -46.23 73.16 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.735 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 568' ' ' ALA . . . . . 0.542 ' HB1' ' HB1' ' A' ' 579' ' ' ALA . . . -67.34 -41.66 84.84 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 111.619 0.229 . . . . 0.0 111.619 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.743 HD11 HD11 ' A' ' 576' ' ' ILE . 3.5 mm? -63.44 -42.56 98.67 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 120.843 0.354 . . . . 0.0 111.921 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 30.7 mm -64.44 -35.13 73.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.173 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -87.53 -17.12 32.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.105 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 572' ' ' THR . . . . . 0.608 ' HB ' ' HB3' ' A' ' 575' ' ' ASP . 76.4 p -106.43 0.82 25.11 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 53.7 30.73 44.14 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.931 -0.652 . . . . 0.0 113.773 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 102.52 -2.16 49.69 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.891 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 575' ' ' ASP . . . . . 0.608 ' HB3' ' HB ' ' A' ' 572' ' ' THR . 2.6 t0 -77.75 77.73 4.26 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.743 HD11 HD11 ' A' ' 569' ' ' LEU . 10.4 mm -58.18 -35.08 51.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.941 -177.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 577' ' ' ASN . . . . . 0.633 ' HA ' HG13 ' A' ' 580' ' ' ILE . 5.9 m-80 -67.76 -45.14 75.77 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.036 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 578' ' ' ALA . . . . . 0.51 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -61.88 -34.49 76.11 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.502 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 579' ' ' ALA . . . . . 0.542 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -71.83 -30.98 66.06 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.893 -1.048 . . . . 0.0 110.915 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 580' ' ' ILE . . . . . 0.633 HG13 ' HA ' ' A' ' 577' ' ' ASN . 3.5 mt -61.1 -56.82 15.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.616 0 CA-C-O 121.364 0.602 . . . . 0.0 110.839 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -65.36 -29.66 70.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.116 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 582' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 578' ' ' ALA . 1.1 ttt180 -77.13 -47.64 19.87 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 583' ' ' LEU . . . . . 0.651 ' HG ' ' CE2' ' A' ' 559' ' ' PHE . 3.3 tm? -53.49 -58.04 8.56 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-O 121.212 0.529 . . . . 0.0 110.938 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 584' ' ' LEU . . . . . . . . . . . . . 3.5 mt . . . . . 0 N--CA 1.394 -3.245 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.178 -179.749 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 546' ' ' ARG . . . . . 0.73 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 10.4 mmt180 . . . . . 0 C--O 1.223 -0.298 0 CA-C-O 120.616 0.246 . . . . 0.0 111.461 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 547' ' ' PHE . . . . . 0.673 ' HB2' ' HG ' ' A' ' 566' ' ' LEU . 0.1 OUTLIER 32.4 37.85 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 176.712 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 548' ' ' GLN . . . . . 0.69 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 4.7 pt20 23.87 -84.12 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.299 1.04 . . . . 0.0 113.631 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 549' ' ' GLN . . . . . 0.69 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 29.8 pt20 -73.76 -50.33 21.16 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.635 -177.004 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 550' ' ' GLN . . . . . 0.771 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 1.3 mm100 -50.09 -44.09 51.76 Favored 'General case' 0 C--O 1.25 1.082 0 CA-C-O 121.654 0.74 . . . . 0.0 111.541 -178.35 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 551' ' ' LEU . . . . . 0.73 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -72.64 -34.27 67.18 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.6 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -52.17 -32.24 35.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 553' ' ' GLN . . . . . 0.426 ' O ' ' HB3' ' A' ' 556' ' ' ALA . 1.2 mp0 -74.39 -58.53 3.23 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.02 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.941 HD13 HD22 ' A' ' 583' ' ' LEU . 12.5 mt -60.38 -29.29 68.84 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 118.59 -1.244 . . . . 0.0 110.775 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 555' ' ' SER . . . . . 0.436 ' HB2' ' CD1' ' A' ' 551' ' ' LEU . 25.3 t -70.18 -37.4 75.13 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 553' ' ' GLN . . . -55.14 -27.98 49.38 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.794 178.735 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 557' ' ' MET . . . . . 0.466 ' SD ' ' O ' ' A' ' 557' ' ' MET . 0.0 OUTLIER -81.73 19.51 1.06 Allowed 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 122.586 1.184 . . . . 0.0 109.111 178.642 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 558' ' ' GLY . . . . . 0.424 ' H ' ' C ' ' A' ' 556' ' ' ALA . . . 52.81 48.97 56.08 Favored Glycine 0 CA--C 1.524 0.61 0 CA-C-N 114.723 -1.126 . . . . 0.0 113.57 -178.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 559' ' ' PHE . . . . . 0.569 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 0.8 OUTLIER -74.86 -36.82 62.32 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 179.481 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 560' ' ' LEU . . . . . 0.544 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 56.5 mt 74.0 3.54 4.44 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 178.025 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -125.6 95.54 4.48 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 562' ' ' ARG . . . . . 0.509 ' HB2' ' HE ' ' A' ' 546' ' ' ARG . 8.2 mmm180 -60.2 -63.15 1.4 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.374 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -50.17 -38.58 40.33 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.143 0.497 . . . . 0.0 111.934 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -68.73 -24.96 64.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.779 -178.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 565' ' ' ASN . . . . . 0.728 ' O ' HD23 ' A' ' 569' ' ' LEU . 7.9 m120 -80.26 -51.17 9.24 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 566' ' ' LEU . . . . . 0.721 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.5 OUTLIER -51.5 -36.45 44.68 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -177.925 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -68.57 -42.84 77.73 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.564 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 568' ' ' ALA . . . . . 0.524 ' HB1' ' HB1' ' A' ' 579' ' ' ALA . . . -61.53 -28.35 69.26 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.763 176.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.771 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 4.3 mm? -72.54 -52.08 17.18 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.47 -178.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 89.1 mt -67.8 -39.5 82.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.175 0.512 . . . . 0.0 109.779 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -63.19 -19.64 64.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.564 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 572' ' ' THR . . . . . 0.413 HG21 ' HB2' ' A' ' 579' ' ' ALA . 34.6 p -108.23 -39.57 5.43 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 119.739 -0.785 . . . . 0.0 110.31 179.255 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 91.07 39.77 5.67 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.859 -0.686 . . . . 0.0 113.179 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 114.93 -30.18 6.99 Favored Glycine 0 C--N 1.333 0.391 0 C-N-CA 120.32 -0.943 . . . . 0.0 112.676 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -75.89 85.94 2.84 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 576' ' ' ILE . . . . . 0.602 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -73.99 -28.14 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.664 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.931 -177.244 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 577' ' ' ASN . . . . . 0.661 ' HA ' HG13 ' A' ' 580' ' ' ILE . 14.7 m-80 -68.73 -53.28 22.95 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 124.257 0.973 . . . . 0.0 108.722 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -60.08 -30.04 68.97 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.258 -1.337 . . . . 0.0 107.756 177.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 579' ' ' ALA . . . . . 0.524 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -74.25 -28.89 61.44 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.777 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 580' ' ' ILE . . . . . 0.661 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.2 mt -67.01 -42.38 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-O 121.302 0.572 . . . . 0.0 110.286 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 581' ' ' GLU . . . . . 0.637 ' HA ' HD23 ' A' ' 584' ' ' LEU . 37.7 tt0 -69.89 -40.49 75.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.826 -178.283 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 582' ' ' ARG . . . . . 0.632 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -76.32 -35.14 58.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.148 -178.554 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 583' ' ' LEU . . . . . 0.941 HD22 HD13 ' A' ' 554' ' ' LEU . 13.4 tp -71.45 -32.24 68.1 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-O 121.072 0.463 . . . . 0.0 110.371 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 584' ' ' LEU . . . . . 0.637 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.41 -2.43 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.163 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 76.0 p -158.24 72.34 3.96 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.674 0.273 . . . . 0.0 111.015 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 538' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -79.97 -178.29 4.42 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.551 2.168 . . . . 0.0 111.959 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -103.83 117.72 35.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.003 0.43 . . . . 0.0 110.544 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 540' ' ' PHE . . . . . 0.505 ' O ' HD11 ' A' ' 566' ' ' LEU . 87.9 m-85 -58.4 -12.32 3.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.573 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -61.53 -53.13 60.44 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.686 0.279 . . . . 0.0 111.644 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 542' ' ' ASN . . . . . 0.49 ' HB3' ' HG2' ' A' ' 544' ' ' GLU . 90.8 m-20 -52.95 137.1 46.56 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.22 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 543' ' ' PRO . . . . . 0.471 ' HB2' ' HG3' ' A' ' 563' ' ' GLU . 92.7 Cg_endo -78.73 5.22 5.78 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.524 2.149 . . . . 0.0 112.358 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 544' ' ' GLU . . . . . 0.49 ' HG2' ' HB3' ' A' ' 542' ' ' ASN . 10.4 pt-20 -73.48 -54.22 8.76 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 545' ' ' VAL . . . . . 0.437 ' N ' ' HG3' ' A' ' 544' ' ' GLU . 97.0 t -61.51 -40.33 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 546' ' ' ARG . . . . . 0.687 ' HA ' ' HB2' ' A' ' 566' ' ' LEU . 5.8 mtm180 65.07 30.28 11.72 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.227 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 547' ' ' PHE . . . . . 0.676 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 63.99 18.23 11.08 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 -177.873 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 548' ' ' GLN . . . . . 0.472 ' HA ' HD23 ' A' ' 551' ' ' LEU . 3.2 mt-30 29.89 -78.7 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 113.773 -1.558 . . . . 0.0 114.133 177.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 549' ' ' GLN . . . . . 0.558 ' O ' ' HB3' ' A' ' 552' ' ' GLU . 81.3 mm-40 -71.4 -50.82 28.15 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.425 -177.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 550' ' ' GLN . . . . . 0.796 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 2.1 mm-40 -52.09 -40.67 61.58 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.088 -0.96 . . . . 0.0 108.874 178.281 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 551' ' ' LEU . . . . . 0.548 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -62.63 -40.74 97.96 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.724 177.706 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 552' ' ' GLU . . . . . 0.558 ' HB3' ' O ' ' A' ' 549' ' ' GLN . 5.1 tp10 -53.59 -32.12 49.73 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.55 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 553' ' ' GLN . . . . . 0.412 ' CB ' HG21 ' A' ' 576' ' ' ILE . 7.8 mp0 -77.39 -58.46 3.26 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 118.826 -0.607 . . . . 0.0 112.614 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.655 HD13 HD22 ' A' ' 583' ' ' LEU . 10.9 mt -57.85 -32.43 67.63 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 120.43 1.468 . . . . 0.0 110.369 178.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 555' ' ' SER . . . . . 0.427 ' HB2' HD12 ' A' ' 551' ' ' LEU . 44.9 t -68.9 -40.16 79.3 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -55.35 -27.17 45.51 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.503 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 557' ' ' MET . . . . . 0.715 ' HG3' HD13 ' A' ' 580' ' ' ILE . 26.5 mmm -89.31 24.98 2.03 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.898 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 75.56 39.94 33.68 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 115.416 0.926 . . . . 0.0 115.416 178.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 559' ' ' PHE . . . . . 0.498 ' HB2' ' O ' ' A' ' 554' ' ' LEU . 10.3 m-85 -104.44 126.89 51.95 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 118.189 0.995 . . . . 0.0 110.662 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 87.9 mt -96.31 -18.85 19.69 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -77.18 82.2 3.67 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 562' ' ' ARG . . . . . 0.604 ' HA ' ' ND2' ' A' ' 565' ' ' ASN . 15.6 mmt180 -59.89 -53.54 56.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.791 -177.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 563' ' ' GLU . . . . . 0.471 ' HG3' ' HB2' ' A' ' 543' ' ' PRO . 1.8 mp0 -52.33 -31.85 35.2 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.457 0.646 . . . . 0.0 110.794 178.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -73.47 -23.24 60.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.012 -178.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 565' ' ' ASN . . . . . 0.793 ' O ' HD23 ' A' ' 569' ' ' LEU . 14.8 m-20 -78.65 -47.8 16.32 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.687 ' HB2' ' HA ' ' A' ' 546' ' ' ARG . 0.6 OUTLIER -52.48 -47.92 66.23 Favored 'General case' 0 N--CA 1.42 -1.926 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.772 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -72.34 -38.12 68.69 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.981 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 568' ' ' ALA . . . . . 0.412 ' HB3' ' CD1' ' A' ' 554' ' ' LEU . . . -60.39 -31.89 70.79 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 118.93 -1.108 . . . . 0.0 108.424 178.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.796 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 4.0 mm? -73.84 -37.43 64.82 Favored 'General case' 0 N--CA 1.428 -1.561 0 CA-C-O 120.893 0.377 . . . . 0.0 111.818 -178.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 22.7 mm -65.43 -38.6 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.778 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -81.13 -15.53 55.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.394 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 572' ' ' THR . . . . . 0.592 HG21 ' HB2' ' A' ' 579' ' ' ALA . 39.6 p -104.86 4.59 32.23 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 47.4 32.01 7.05 Favored Glycine 0 C--N 1.337 0.585 0 N-CA-C 115.027 0.771 . . . . 0.0 115.027 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 108.1 -17.46 34.85 Favored Glycine 0 C--O 1.229 -0.178 0 C-N-CA 120.078 -1.058 . . . . 0.0 113.212 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 575' ' ' ASP . . . . . 0.479 ' HB3' ' HB3' ' A' ' 578' ' ' ALA . 3.3 m-20 -75.27 78.82 2.37 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.684 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -67.54 -33.86 64.77 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.976 -177.079 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 577' ' ' ASN . . . . . 0.57 ' HA ' HG13 ' A' ' 580' ' ' ILE . 2.9 m-20 -66.29 -46.68 76.15 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 124.334 1.021 . . . . 0.0 108.697 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 578' ' ' ALA . . . . . 0.479 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -62.55 -31.04 71.76 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.981 -1.463 . . . . 0.0 107.742 177.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 579' ' ' ALA . . . . . 0.592 ' HB2' HG21 ' A' ' 572' ' ' THR . . . -74.26 -33.9 63.44 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.271 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 580' ' ' ILE . . . . . 0.715 HD13 ' HG3' ' A' ' 557' ' ' MET . 3.7 mt -62.78 -44.02 99.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 121.444 0.64 . . . . 0.0 110.431 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 581' ' ' GLU . . . . . 0.444 ' HA ' HD23 ' A' ' 584' ' ' LEU . 39.7 mt-10 -68.94 -39.17 79.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.711 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 582' ' ' ARG . . . . . . . . . . . . . 2.2 ttt85 -77.44 -40.8 42.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.406 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 583' ' ' LEU . . . . . 0.655 HD22 HD13 ' A' ' 554' ' ' LEU . 8.2 tp -62.52 -44.58 96.01 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.624 -177.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 584' ' ' LEU . . . . . 0.504 ' O ' HD12 ' A' ' 584' ' ' LEU . 0.2 OUTLIER -69.14 -18.96 64.01 Favored 'General case' 0 N--CA 1.42 -1.972 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -58.37 -73.75 0.43 Allowed Glycine 0 C--N 1.335 0.507 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.811 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 54.2 m -147.62 -61.54 0.27 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.892 0.377 . . . . 0.0 110.513 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.945 179.948 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 537' ' ' SER . . . . . 0.557 ' HB3' ' HD3' ' A' ' 538' ' ' PRO . 42.4 t -92.94 -49.67 0.28 Allowed Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 111.539 0.199 . . . . 0.0 111.539 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 538' ' ' PRO . . . . . 0.557 ' HD3' ' HB3' ' A' ' 537' ' ' SER . 8.8 Cg_exo -72.09 -147.86 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.413 2.076 . . . . 0.0 112.378 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 62.92 -99.51 0.08 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.213 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -61.96 -6.14 2.63 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -74.62 -59.92 2.51 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.424 -0.51 . . . . 0.0 109.671 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -131.48 149.91 74.88 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.332 177.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -84.46 17.73 1.68 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.654 2.236 . . . . 0.0 111.492 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 544' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -74.16 -55.51 5.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.821 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 545' ' ' VAL . . . . . 0.507 ' O ' ' HB2' ' A' ' 546' ' ' ARG . 47.6 t -65.74 -38.93 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 546' ' ' ARG . . . . . 0.601 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 6.3 mtm180 70.37 36.07 1.86 Allowed 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.284 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 547' ' ' PHE . . . . . 0.564 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 59.34 22.6 10.99 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 -178.13 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 548' ' ' GLN . . . . . 0.728 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.9 pt20 29.42 -79.16 0.0 OUTLIER 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.516 1.527 . . . . 0.0 114.325 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 549' ' ' GLN . . . . . 0.728 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 97.1 mt-30 -71.7 -49.84 35.79 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.752 0.787 . . . . 0.0 111.006 -177.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 550' ' ' GLN . . . . . 0.633 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 11.2 mp0 -52.28 -40.33 61.63 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.345 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 551' ' ' LEU . . . . . 0.601 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -60.22 -40.23 89.43 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.749 176.684 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 552' ' ' GLU . . . . . 0.523 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 42.1 mt-10 -53.33 -32.35 48.62 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.752 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 553' ' ' GLN . . . . . 0.454 ' CD ' HD12 ' A' ' 576' ' ' ILE . 1.7 mp0 -78.29 -59.02 2.95 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 118.925 -0.56 . . . . 0.0 112.057 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.586 HD12 HD23 ' A' ' 569' ' ' LEU . 8.1 mt -54.28 -33.02 57.75 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 120.092 1.315 . . . . 0.0 110.992 177.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 555' ' ' SER . . . . . 0.418 ' HB2' HD12 ' A' ' 551' ' ' LEU . 48.4 t -69.91 -39.8 75.99 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.35 -33.46 59.09 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 43.1 mmm -97.58 22.09 9.42 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.177 0.898 . . . . 0.0 111.077 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 558' ' ' GLY . . . . . 0.413 ' O ' ' O ' ' A' ' 559' ' ' PHE . . . 117.14 -118.85 4.26 Favored Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 559' ' ' PHE . . . . . 0.449 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 90.4 m-85 29.85 112.01 0.0 OUTLIER 'General case' 0 C--O 1.232 0.139 0 N-CA-C 116.018 1.859 . . . . 0.0 116.018 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 68.3 mt -107.83 8.92 28.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.533 178.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.578 ' HB2' ' HB3' ' A' ' 564' ' ' ALA . 0.3 OUTLIER -87.9 105.75 17.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.136 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 562' ' ' ARG . . . . . 0.569 ' HD2' ' HD3' ' A' ' 546' ' ' ARG . 24.2 mmt180 -59.6 -68.75 0.25 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.555 -178.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -32.11 31.15 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.217 -179.149 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 564' ' ' ALA . . . . . 0.578 ' HB3' ' HB2' ' A' ' 561' ' ' ASN . . . -76.76 -24.72 52.96 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -177.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 565' ' ' ASN . . . . . 0.599 ' O ' HD23 ' A' ' 569' ' ' LEU . 86.1 m-20 -78.68 -49.84 12.45 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 120.816 0.341 . . . . 0.0 110.61 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.541 HD12 ' N ' ' A' ' 547' ' ' PHE . 1.1 tp -57.31 -45.77 83.88 Favored 'General case' 0 N--CA 1.421 -1.883 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.139 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -71.94 -40.22 68.88 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 568' ' ' ALA . . . . . 0.582 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -57.29 -30.32 64.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.21 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.633 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.3 mm? -72.68 -34.93 67.54 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.496 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 570' ' ' ILE . . . . . 0.425 HD13 ' HE2' ' A' ' 547' ' ' PHE . 39.1 mm -73.86 -42.1 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-O 121.474 0.654 . . . . 0.0 109.246 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -57.62 -29.21 64.34 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.726 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 32.0 p -99.37 -38.73 8.72 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.766 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 93.88 27.47 12.53 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.891 -0.671 . . . . 0.0 113.227 177.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 126.28 -33.04 3.58 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.49 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.8 79.64 1.13 Allowed 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.637 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -64.83 -36.09 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.927 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.12 -176.819 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 577' ' ' ASN . . . . . 0.587 ' HA ' HG13 ' A' ' 580' ' ' ILE . 2.8 m-20 -65.22 -40.2 93.8 Favored 'General case' 0 N--CA 1.442 -0.834 0 O-C-N 124.324 1.015 . . . . 0.0 108.501 179.223 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -66.59 -33.26 75.28 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.027 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 579' ' ' ALA . . . . . 0.526 ' HA ' ' HG2' ' A' ' 582' ' ' ARG . . . -73.51 -33.64 64.87 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.855 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 580' ' ' ILE . . . . . 0.637 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.8 mt -61.62 -48.67 87.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 121.494 0.664 . . . . 0.0 110.599 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 581' ' ' GLU . . . . . 0.567 ' HA ' HD23 ' A' ' 584' ' ' LEU . 37.4 tt0 -67.67 -36.83 81.44 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.895 -178.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 582' ' ' ARG . . . . . 0.64 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -77.87 -38.98 44.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.183 0.516 . . . . 0.0 110.647 -179.199 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 583' ' ' LEU . . . . . 0.64 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 11.2 tp -63.91 -40.41 96.43 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 123.674 0.79 . . . . 0.0 110.878 -178.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 584' ' ' LEU . . . . . 0.567 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER -79.77 -17.16 54.1 Favored 'General case' 0 N--CA 1.419 -2.021 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.974 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -76.36 7.87 28.84 Favored Glycine 0 C--N 1.334 0.454 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.757 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 77.9 p -143.48 52.7 1.34 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 0.0 110.87 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.062 -179.819 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.523 -0.231 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 537' ' ' SER . . . . . 0.667 ' H ' ' HD2' ' A' ' 538' ' ' PRO . 66.1 m -157.37 -53.5 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.338 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 538' ' ' PRO . . . . . 0.667 ' HD2' ' H ' ' A' ' 537' ' ' SER . 73.2 Cg_endo -75.11 87.45 1.33 Allowed 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.041 1.827 . . . . 0.0 112.317 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -131.14 -46.01 1.01 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.653 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -69.64 -30.59 68.34 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.677 0.275 . . . . 0.0 111.13 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 541' ' ' GLN . . . . . 0.409 ' HG3' ' N ' ' A' ' 542' ' ' ASN . 4.1 pt20 -59.28 -48.58 81.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.236 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 542' ' ' ASN . . . . . 0.409 ' N ' ' HG3' ' A' ' 541' ' ' GLN . 81.7 m-20 -62.89 137.99 97.03 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.109 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -80.89 10.07 3.52 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.607 2.205 . . . . 0.0 112.859 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 544' ' ' GLU . . . . . 0.481 ' HG3' ' H ' ' A' ' 545' ' ' VAL . 7.8 pt-20 -72.54 -55.61 6.67 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 545' ' ' VAL . . . . . 0.577 HG12 ' H ' ' A' ' 548' ' ' GLN . 55.5 t -67.94 -39.18 81.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 546' ' ' ARG . . . . . 0.798 HH11 ' HG3' ' A' ' 546' ' ' ARG . 0.0 OUTLIER 72.58 38.01 0.83 Allowed 'General case' 0 N--CA 1.421 -1.921 0 CA-C-N 114.247 -1.342 . . . . 0.0 112.361 179.097 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 547' ' ' PHE . . . . . 0.583 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.08 28.69 10.25 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 119.322 -0.951 . . . . 0.0 109.713 178.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 548' ' ' GLN . . . . . 0.717 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 6.5 pt20 28.16 -81.6 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 125.004 1.322 . . . . 0.0 114.228 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 549' ' ' GLN . . . . . 0.717 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 3.7 pt20 -73.34 -50.07 23.95 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.334 -178.005 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 550' ' ' GLN . . . . . 0.702 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 11.9 mp0 -50.11 -36.26 29.01 Favored 'General case' 0 C--O 1.245 0.843 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 177.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 551' ' ' LEU . . . . . 0.749 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -62.68 -45.15 94.13 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 114.137 -1.392 . . . . 0.0 109.928 177.0 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 552' ' ' GLU . . . . . 0.59 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 14.6 mm-40 -52.87 -32.09 42.97 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.362 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 553' ' ' GLN . . . . . 0.629 ' HG3' HD12 ' A' ' 576' ' ' ILE . 3.8 mm100 -73.61 -60.24 2.34 Favored 'General case' 0 C--O 1.246 0.894 0 N-CA-C 112.424 0.528 . . . . 0.0 112.424 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.938 HD13 HD22 ' A' ' 583' ' ' LEU . 11.6 mt -62.91 -29.86 71.1 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.535 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 555' ' ' SER . . . . . 0.566 ' HB2' HD12 ' A' ' 551' ' ' LEU . 46.7 t -69.73 -38.47 76.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -55.91 -26.58 48.21 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.434 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 557' ' ' MET . . . . . 0.618 ' HG3' HD13 ' A' ' 580' ' ' ILE . 84.8 mmm -87.34 25.32 1.42 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.317 0.58 . . . . 0.0 110.138 178.725 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 44.31 44.15 7.73 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-N 114.728 -1.124 . . . . 0.0 113.633 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 559' ' ' PHE . . . . . 0.486 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 1.6 m-85 -76.11 -41.96 48.6 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 113.353 0.872 . . . . 0.0 113.353 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 23.4 mt 66.28 7.15 4.68 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 178.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -108.98 79.56 1.23 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 562' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 562' ' ' ARG . 7.1 mmt180 -58.65 -29.07 66.26 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.59 -178.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -65.16 -51.84 58.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.075 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.81 -25.1 44.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.253 -178.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 565' ' ' ASN . . . . . 0.485 ' O ' HD23 ' A' ' 569' ' ' LEU . 7.1 m120 -60.8 -58.02 10.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.781 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.648 HD13 ' HA ' ' A' ' 546' ' ' ARG . 2.1 tp -63.82 -30.95 71.99 Favored 'General case' 0 N--CA 1.424 -1.751 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -69.9 -32.01 70.1 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.385 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 568' ' ' ALA . . . . . 0.651 ' HB1' ' HB1' ' A' ' 579' ' ' ALA . . . -77.36 -38.91 49.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.859 0.362 . . . . 0.0 110.768 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.702 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.9 mm? -64.05 -49.56 71.87 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.224 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 83.4 mt -70.07 -39.74 77.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.259 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -67.96 -15.33 63.56 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 48.7 p -108.13 -40.89 5.07 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 119.756 -0.778 . . . . 0.0 110.324 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 94.42 43.45 3.71 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.378 -0.915 . . . . 0.0 112.652 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 110.84 -33.42 5.91 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.343 -0.932 . . . . 0.0 112.271 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.96 87.51 1.33 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.629 HD12 ' HG3' ' A' ' 553' ' ' GLN . 0.6 OUTLIER -77.62 -27.0 15.28 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.425 -176.836 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 577' ' ' ASN . . . . . 0.683 ' HA ' HG13 ' A' ' 580' ' ' ILE . 4.5 m-20 -68.84 -53.64 20.27 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -58.44 -29.87 66.49 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.249 -1.341 . . . . 0.0 107.76 176.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 579' ' ' ALA . . . . . 0.651 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -74.82 -27.44 60.29 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.12 -1.4 . . . . 0.0 110.929 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 580' ' ' ILE . . . . . 0.683 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.3 mt -69.51 -43.42 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 121.081 0.467 . . . . 0.0 110.604 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 581' ' ' GLU . . . . . 0.673 ' HA ' HD23 ' A' ' 584' ' ' LEU . 41.6 tt0 -69.49 -38.02 77.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.217 -178.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 582' ' ' ARG . . . . . 0.65 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -75.41 -32.12 60.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.497 -179.335 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 583' ' ' LEU . . . . . 0.938 HD22 HD13 ' A' ' 554' ' ' LEU . 8.1 tp -72.14 -31.89 66.41 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.79 -178.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 584' ' ' LEU . . . . . 0.697 ' HG ' ' H ' ' A' ' 586' ' ' SER . 0.1 OUTLIER -78.9 -13.57 59.72 Favored 'General case' 0 N--CA 1.408 -2.531 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 96.17 -7.36 66.8 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-N 114.539 -1.209 . . . . 0.0 112.837 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 586' ' ' SER . . . . . 0.697 ' H ' ' HG ' ' A' ' 584' ' ' LEU . 41.0 t 42.2 70.61 0.27 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.728 0.299 . . . . 0.0 111.257 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 48.3 t . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.066 -179.875 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.138 0 N-CA-C 112.529 -0.229 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 537' ' ' SER . . . . . 0.511 ' HB2' ' HD3' ' A' ' 538' ' ' PRO . 73.2 m -76.83 -51.44 2.23 Favored Pre-proline 0 CA--C 1.534 0.348 0 N-CA-C 111.328 0.121 . . . . 0.0 111.328 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 538' ' ' PRO . . . . . 0.511 ' HD3' ' HB2' ' A' ' 537' ' ' SER . 87.0 Cg_endo -79.03 70.15 7.62 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.195 1.93 . . . . 0.0 112.399 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 539' ' ' GLU . . . . . 0.43 ' HB2' HG21 ' A' ' 545' ' ' VAL . 44.8 mt-10 -45.98 120.43 2.71 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.158 0.504 . . . . 0.0 111.816 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -99.2 1.51 44.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.702 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -72.22 -56.0 6.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.711 -175.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -127.38 153.08 77.17 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.739 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 543' ' ' PRO . . . . . 0.585 ' HA ' HD12 ' A' ' 566' ' ' LEU . 79.1 Cg_endo -78.02 12.78 1.9 Allowed 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.727 2.284 . . . . 0.0 112.696 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 544' ' ' GLU . . . . . 0.417 ' HG3' HG23 ' A' ' 545' ' ' VAL . 12.0 pt-20 -67.4 -43.58 80.94 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 545' ' ' VAL . . . . . 0.728 ' O ' ' HG2' ' A' ' 546' ' ' ARG . 28.4 t -76.09 -32.36 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 114.53 -1.213 . . . . 0.0 108.003 177.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 546' ' ' ARG . . . . . 0.728 ' HG2' ' O ' ' A' ' 545' ' ' VAL . 2.2 ptt180 49.34 52.0 15.27 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.367 178.295 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 547' ' ' PHE . . . . . 0.587 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 60.38 18.63 8.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.043 179.02 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 548' ' ' GLN . . . . . 0.717 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.8 pt20 28.29 -76.17 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 177.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 549' ' ' GLN . . . . . 0.717 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 12.4 mm100 -72.21 -50.81 24.59 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.559 0.695 . . . . 0.0 110.897 -178.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 550' ' ' GLN . . . . . 0.587 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 10.9 mp0 -53.93 -42.18 68.54 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 551' ' ' LEU . . . . . 0.659 HD22 ' CG ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -56.5 -40.84 75.65 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.24 176.167 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 552' ' ' GLU . . . . . 0.598 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 14.3 tt0 -55.4 -32.54 62.73 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.443 -179.091 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 553' ' ' GLN . . . . . 0.504 ' HB3' HG21 ' A' ' 576' ' ' ILE . 1.0 OUTLIER -74.28 -58.18 3.46 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.293 179.347 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.653 HD11 ' HB3' ' A' ' 568' ' ' ALA . 7.9 mt -55.81 -29.85 60.41 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.485 177.392 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 44.0 t -70.26 -39.36 75.04 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 553' ' ' GLN . . . -54.26 -35.14 62.2 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.467 -0.788 . . . . 0.0 113.084 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 10.8 mtp -97.97 21.37 10.76 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.006 0.821 . . . . 0.0 110.801 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 119.53 -118.49 3.96 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.751 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 559' ' ' PHE . . . . . 0.402 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 83.9 m-85 28.39 108.35 0.0 OUTLIER 'General case' 0 C--O 1.232 0.17 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.5 12.38 29.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 113.91 -1.495 . . . . 0.0 108.86 178.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.472 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 49.5 t-20 -97.78 109.34 22.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.684 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 562' ' ' ARG . . . . . 0.619 ' HB3' ' HD2' ' A' ' 546' ' ' ARG . 27.0 mmt180 -59.33 -61.8 2.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.158 -178.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -35.52 64.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.214 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 564' ' ' ALA . . . . . 0.472 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -77.58 -25.73 50.2 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -177.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 565' ' ' ASN . . . . . 0.545 ' O ' HD23 ' A' ' 569' ' ' LEU . 78.0 m-20 -71.53 -55.62 7.48 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.441 -0.504 . . . . 0.0 109.929 -179.156 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.665 HD12 ' HA ' ' A' ' 546' ' ' ARG . 0.3 OUTLIER -55.98 -46.0 78.78 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.248 -179.567 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -61.21 -42.21 98.19 Favored 'General case' 0 CA--C 1.504 -0.826 0 C-N-CA 119.359 -0.936 . . . . 0.0 112.93 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 568' ' ' ALA . . . . . 0.653 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -62.12 -28.41 69.62 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 118.857 -1.137 . . . . 0.0 108.295 177.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.64 HD11 HD13 ' A' ' 576' ' ' ILE . 3.0 mm? -73.11 -42.97 62.36 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 41.5 mm -72.55 -36.97 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 571' ' ' ALA . . . . . 0.533 ' HB1' HH12 ' A' ' 582' ' ' ARG . . . -57.03 -32.32 66.06 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.959 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 33.9 p -100.18 -38.56 8.46 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.402 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 94.15 27.74 11.78 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.006 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 127.9 -31.78 3.62 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.419 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -75.48 77.46 2.52 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.651 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.6 OUTLIER -63.95 -37.25 79.28 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.811 0 CA-C-N 114.775 -1.102 . . . . 0.0 111.243 -176.598 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 577' ' ' ASN . . . . . 0.525 ' HA ' HG13 ' A' ' 580' ' ' ILE . 7.8 m-80 -63.97 -42.37 97.27 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 124.207 0.942 . . . . 0.0 108.848 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 578' ' ' ALA . . . . . 0.436 ' O ' ' HD2' ' A' ' 582' ' ' ARG . . . -64.41 -39.5 93.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 113.969 -1.469 . . . . 0.0 107.605 177.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 579' ' ' ALA . . . . . 0.696 ' HA ' ' HD3' ' A' ' 582' ' ' ARG . . . -64.12 -35.43 80.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 114.4 -1.273 . . . . 0.0 110.503 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 580' ' ' ILE . . . . . 0.651 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.4 mt -63.4 -37.16 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 CA-C-O 121.205 0.526 . . . . 0.0 110.124 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -66.63 -44.4 82.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.326 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 582' ' ' ARG . . . . . 0.696 ' HD3' ' HA ' ' A' ' 579' ' ' ALA . 0.0 OUTLIER -80.46 -41.07 25.06 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.581 -0.447 . . . . 0.0 111.339 -178.961 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 583' ' ' LEU . . . . . 0.48 ' HB3' ' O ' ' A' ' 579' ' ' ALA . 12.8 tp -58.07 -42.04 84.7 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.703 -178.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 584' ' ' LEU . . . . . 0.488 ' HB3' ' O ' ' A' ' 580' ' ' ILE . 0.2 OUTLIER -85.29 -20.96 29.24 Favored 'General case' 0 N--CA 1.412 -2.349 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 177.85 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -59.56 -77.88 0.16 Allowed Glycine 0 C--N 1.339 0.703 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.566 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 51.4 m 59.06 -173.89 0.1 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.918 0.389 . . . . 0.0 111.228 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.93 -179.98 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.127 0 N-CA-C 112.508 -0.237 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 50.8 m -149.09 115.06 3.67 Favored Pre-proline 0 CA--C 1.531 0.217 0 O-C-N 122.994 -0.121 . . . . 0.0 110.816 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' PRO . . . . . 0.417 ' HA ' ' CD ' ' A' ' 552' ' ' GLU . 45.0 Cg_endo -68.22 159.94 51.02 Favored 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.268 1.979 . . . . 0.0 112.277 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 539' ' ' GLU . . . . . 0.491 ' HB3' ' HB3' ' A' ' 543' ' ' PRO . 0.3 OUTLIER 55.77 105.89 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.578 -179.817 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -93.71 -76.04 0.49 Allowed 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 119.695 -0.802 . . . . 0.0 112.718 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -83.06 -67.69 0.77 Allowed 'General case' 0 C--O 1.232 0.166 0 C-N-CA 119.672 -0.811 . . . . 0.0 112.24 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 542' ' ' ASN . . . . . 0.468 ' HB2' HH12 ' A' ' 546' ' ' ARG . 19.2 m120 -141.22 111.17 6.51 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.019 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 543' ' ' PRO . . . . . 0.593 ' HA ' ' HA ' ' A' ' 548' ' ' GLN . 68.7 Cg_endo -87.77 -9.18 5.71 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.224 1.949 . . . . 0.0 111.351 178.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 544' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -73.11 -32.56 65.03 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.037 -1.438 . . . . 0.0 112.024 -178.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 545' ' ' VAL . . . . . 0.549 ' HB ' ' NE ' ' A' ' 546' ' ' ARG . 60.5 t -85.07 -68.28 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 546' ' ' ARG . . . . . 0.774 ' HD2' HD22 ' A' ' 551' ' ' LEU . 0.0 OUTLIER -101.03 117.13 34.42 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -177.568 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 547' ' ' PHE . . . . . 0.627 ' HD2' HD23 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 22.95 37.37 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.224 1.564 . . . . 0.0 115.224 172.774 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 548' ' ' GLN . . . . . 0.693 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 6.4 pt20 28.31 -86.24 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 549' ' ' GLN . . . . . 0.693 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 75.6 mt-30 -73.33 -51.5 17.24 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.225 -177.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 550' ' ' GLN . . . . . 0.534 ' HB3' ' CD1' ' A' ' 569' ' ' LEU . 2.5 mp0 -51.36 -42.24 61.19 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-O 121.441 0.639 . . . . 0.0 110.759 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 551' ' ' LEU . . . . . 0.774 HD22 ' HD2' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -63.09 -39.21 94.05 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.353 177.685 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 552' ' ' GLU . . . . . 0.541 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 12.5 tt0 -51.78 -31.93 29.0 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.331 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 553' ' ' GLN . . . . . 0.56 ' HG2' HD12 ' A' ' 576' ' ' ILE . 1.1 mp0 -75.33 -58.84 3.04 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.755 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.649 HD13 HD22 ' A' ' 583' ' ' LEU . 8.4 mt -55.1 -36.99 66.26 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 119.111 -1.036 . . . . 0.0 111.506 178.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 4.9 m -67.92 -37.34 81.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 553' ' ' GLN . . . -53.97 -34.89 61.01 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.716 -0.675 . . . . 0.0 112.803 179.326 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 557' ' ' MET . . . . . 0.617 ' HG3' HG21 ' A' ' 580' ' ' ILE . 40.7 mmm -83.28 28.39 0.53 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.08 0.855 . . . . 0.0 111.786 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 74.44 40.84 38.66 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 115.361 0.904 . . . . 0.0 115.361 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -113.33 134.19 54.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 117.551 0.676 . . . . 0.0 109.943 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 93.5 mt -111.51 -1.04 15.99 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -178.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.716 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 11.7 t-20 -81.75 102.64 10.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.148 0.499 . . . . 0.0 110.277 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 562' ' ' ARG . . . . . 0.594 ' HB3' ' NE ' ' A' ' 546' ' ' ARG . 18.2 mmt180 -57.94 -70.97 0.12 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.87 -178.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -49.41 -33.75 14.68 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.983 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 564' ' ' ALA . . . . . 0.716 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -76.03 -23.82 55.16 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 565' ' ' ASN . . . . . 0.6 ' O ' HD23 ' A' ' 569' ' ' LEU . 86.1 m-20 -79.56 -51.0 9.86 Favored 'General case' 0 CA--C 1.512 -0.49 0 C-N-CA 120.551 -0.459 . . . . 0.0 110.268 -178.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.629 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.4 OUTLIER -58.57 -43.86 89.56 Favored 'General case' 0 N--CA 1.424 -1.728 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.232 -178.702 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -66.13 -43.48 87.0 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.796 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 568' ' ' ALA . . . . . 0.533 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -56.99 -30.03 63.8 Favored 'General case' 0 C--N 1.312 -1.056 0 C-N-CA 118.901 -1.119 . . . . 0.0 108.031 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.6 HD23 ' O ' ' A' ' 565' ' ' ASN . 3.2 mm? -73.83 -46.0 47.8 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 75.5 mt -71.16 -43.43 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 CA-C-O 121.435 0.636 . . . . 0.0 109.348 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -57.51 -24.04 53.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.752 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 572' ' ' THR . . . . . 0.484 HG22 ' NH2' ' A' ' 582' ' ' ARG . 35.1 p -100.66 -37.58 8.69 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 120.217 -0.593 . . . . 0.0 109.857 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 92.75 30.56 9.49 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.896 -0.593 . . . . 0.0 113.682 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 119.41 -29.85 5.99 Favored Glycine 0 C--O 1.228 -0.262 0 C-N-CA 120.361 -0.923 . . . . 0.0 112.624 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 575' ' ' ASP . . . . . 0.465 ' HB3' ' HB3' ' A' ' 578' ' ' ALA . 1.2 t0 -72.65 82.73 1.14 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 178.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.638 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -71.81 -34.92 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.705 0 CA-C-N 115.243 -0.89 . . . . 0.0 111.204 -176.874 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 577' ' ' ASN . . . . . 0.616 ' HA ' HG13 ' A' ' 580' ' ' ILE . 9.6 m-80 -64.79 -45.15 87.52 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 122.121 0.962 . . . . 0.0 108.544 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 578' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -63.14 -31.58 72.75 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 113.6 -1.637 . . . . 0.0 107.792 177.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -75.61 -30.39 59.54 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.472 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 580' ' ' ILE . . . . . 0.638 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.7 mt -66.46 -49.62 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-O 121.383 0.611 . . . . 0.0 110.703 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 581' ' ' GLU . . . . . 0.707 ' HA ' HD23 ' A' ' 584' ' ' LEU . 41.5 tt0 -67.64 -33.75 75.58 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.443 -179.221 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 582' ' ' ARG . . . . . 0.484 ' NH2' HG22 ' A' ' 572' ' ' THR . 0.5 OUTLIER -76.61 -36.1 57.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.583 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 583' ' ' LEU . . . . . 0.649 HD22 HD13 ' A' ' 554' ' ' LEU . 7.9 tp -68.9 -35.32 76.72 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.188 -178.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 584' ' ' LEU . . . . . 0.707 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER -79.26 -18.77 52.12 Favored 'General case' 0 N--CA 1.415 -2.211 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.536 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 168.49 146.89 5.15 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 115.198 -0.91 . . . . 0.0 112.927 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.1 t -76.51 -35.2 58.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.854 0.359 . . . . 0.0 110.798 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 62.2 p . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.344 -0.836 . . . . 0.0 110.881 179.91 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 81.1 p -110.26 122.49 38.53 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.338 0.113 . . . . 0.0 110.838 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -77.77 73.63 5.58 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.266 1.978 . . . . 0.0 112.274 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 539' ' ' GLU . . . . . 0.452 ' HB2' ' HG2' ' A' ' 544' ' ' GLU . 9.3 pt-20 -154.3 -52.19 0.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.884 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -50.77 -20.46 1.27 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.509 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -74.02 -30.64 62.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.932 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 542' ' ' ASN . . . . . 0.684 ' O ' HG23 ' A' ' 545' ' ' VAL . 2.7 m-20 -90.32 -170.24 0.24 Allowed Pre-proline 0 CA--C 1.54 0.582 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.585 -178.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 543' ' ' PRO . . . . . 0.655 ' HD2' ' HB3' ' A' ' 542' ' ' ASN . 26.5 Cg_exo -38.82 -12.19 0.02 OUTLIER 'Trans proline' 0 C--N 1.369 1.642 0 C-N-CA 123.025 2.484 . . . . 0.0 114.705 179.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 544' ' ' GLU . . . . . 0.538 ' N ' ' O ' ' A' ' 542' ' ' ASN . 0.9 OUTLIER -59.1 -19.54 45.39 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 122.388 1.09 . . . . 0.0 108.095 176.686 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 545' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 542' ' ' ASN . 74.1 t -57.62 -29.59 34.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 176.067 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 546' ' ' ARG . . . . . 0.694 ' HB3' ' HB2' ' A' ' 551' ' ' LEU . 11.3 mmt180 76.73 42.8 0.14 Allowed 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 111.342 -2.663 . . . . 0.0 114.007 176.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 547' ' ' PHE . . . . . 0.638 ' HB2' HD12 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 64.1 31.01 13.7 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 117.919 -1.513 . . . . 0.0 109.085 178.076 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 548' ' ' GLN . . . . . 0.429 ' HG3' ' CG1' ' A' ' 545' ' ' VAL . 7.9 mt-30 30.92 -84.48 0.0 OUTLIER 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.64 -1.164 . . . . 0.0 113.77 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 549' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 547' ' ' PHE . 15.2 mm100 -73.32 -50.68 20.78 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.761 -176.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 550' ' ' GLN . . . . . 0.62 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 6.8 mp0 -49.23 -35.01 16.22 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.109 178.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 551' ' ' LEU . . . . . 0.694 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -65.65 -47.0 77.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.898 177.413 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 552' ' ' GLU . . . . . 0.583 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 6.2 tp10 -53.4 -32.71 50.8 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.821 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 553' ' ' GLN . . . . . 0.653 ' HB3' HG21 ' A' ' 576' ' ' ILE . 52.7 mt-30 -71.72 -58.29 3.61 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.827 HD13 HD22 ' A' ' 583' ' ' LEU . 8.2 mt -60.38 -28.61 68.35 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 119.241 -0.984 . . . . 0.0 109.806 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 555' ' ' SER . . . . . 0.419 ' OG ' HD12 ' A' ' 551' ' ' LEU . 8.0 m -70.09 -39.5 75.54 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.437 ' C ' ' H ' ' A' ' 558' ' ' GLY . . . -55.6 -26.31 43.23 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.831 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 557' ' ' MET . . . . . 0.619 ' HG3' HD13 ' A' ' 580' ' ' ILE . 88.9 mmm -81.53 31.34 0.35 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.578 0.704 . . . . 0.0 110.419 178.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 558' ' ' GLY . . . . . 0.437 ' H ' ' C ' ' A' ' 556' ' ' ALA . . . 64.96 33.33 86.96 Favored Glycine 0 CA--C 1.522 0.498 0 CA-C-N 114.578 -1.192 . . . . 0.0 113.752 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -111.55 141.71 44.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.951 0.375 . . . . 0.0 110.284 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.453 HD12 ' N ' ' A' ' 561' ' ' ASN . 3.8 pp -117.17 -34.69 4.28 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.446 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.541 ' O ' ' ND2' ' A' ' 565' ' ' ASN . 45.0 t-20 -51.36 95.36 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.054 0.454 . . . . 0.0 111.232 -179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 562' ' ' ARG . . . . . 0.58 ' HB3' ' HE ' ' A' ' 546' ' ' ARG . 14.6 mmt180 -55.78 -41.88 74.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.467 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -47.31 -51.29 19.69 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.886 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.5 -24.71 45.7 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.11 0.481 . . . . 0.0 111.016 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 565' ' ' ASN . . . . . 0.782 ' O ' HD23 ' A' ' 569' ' ' LEU . 0.9 OUTLIER -59.89 -58.49 8.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.063 -179.497 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.642 ' HB2' ' HA ' ' A' ' 546' ' ' ARG . 1.1 tp -67.13 -33.78 76.18 Favored 'General case' 0 N--CA 1.423 -1.798 0 O-C-N 122.291 -0.256 . . . . 0.0 110.837 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -70.56 -42.11 71.57 Favored 'General case' 0 CA--C 1.505 -0.782 0 C-N-CA 119.445 -0.902 . . . . 0.0 113.174 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 568' ' ' ALA . . . . . 0.586 ' HB3' ' CD1' ' A' ' 554' ' ' LEU . . . -64.92 -27.11 68.63 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.062 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.782 HD23 ' O ' ' A' ' 565' ' ' ASN . 2.9 mm? -71.24 -53.23 15.09 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.545 -178.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 69.3 mt -70.58 -36.43 65.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.059 0.457 . . . . 0.0 110.394 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -64.2 -23.99 67.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.46 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 572' ' ' THR . . . . . 0.639 HG22 HH21 ' A' ' 582' ' ' ARG . 68.6 p -105.16 -40.63 5.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 119.764 -0.775 . . . . 0.0 110.512 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 98.11 43.48 2.8 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.526 -0.845 . . . . 0.0 113.59 176.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 574' ' ' GLY . . . . . 0.625 ' O ' HG12 ' A' ' 576' ' ' ILE . . . 107.7 -32.83 6.77 Favored Glycine 0 C--O 1.227 -0.282 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.452 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -65.16 90.6 0.09 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.659 ' O ' HG13 ' A' ' 580' ' ' ILE . 1.8 mm -70.56 -34.48 57.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.895 -177.296 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 577' ' ' ASN . . . . . 0.625 ' HA ' HG13 ' A' ' 580' ' ' ILE . 3.9 m-20 -67.29 -50.6 59.6 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.002 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -59.24 -30.59 68.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 113.99 -1.459 . . . . 0.0 107.644 177.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 579' ' ' ALA . . . . . 0.698 ' HB1' HD11 ' A' ' 554' ' ' LEU . . . -75.28 -30.54 60.46 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.122 -1.399 . . . . 0.0 111.533 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 580' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 576' ' ' ILE . 4.4 mt -65.97 -46.33 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-O 121.325 0.583 . . . . 0.0 110.574 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 581' ' ' GLU . . . . . 0.615 ' HA ' HD23 ' A' ' 584' ' ' LEU . 28.6 mm-40 -68.07 -36.56 80.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.815 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 582' ' ' ARG . . . . . 0.639 HH21 HG22 ' A' ' 572' ' ' THR . 1.9 ttp180 -76.43 -34.53 58.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.466 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 583' ' ' LEU . . . . . 0.827 HD22 HD13 ' A' ' 554' ' ' LEU . 6.8 tp -70.45 -33.01 70.81 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.87 -179.032 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 584' ' ' LEU . . . . . 0.751 ' HG ' ' H ' ' A' ' 586' ' ' SER . 0.2 OUTLIER -82.99 -18.65 39.12 Favored 'General case' 0 N--CA 1.415 -2.208 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 80.54 -12.45 33.82 Favored Glycine 0 C--N 1.337 0.609 0 CA-C-N 115.286 -0.87 . . . . 0.0 113.199 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 586' ' ' SER . . . . . 0.751 ' H ' ' HG ' ' A' ' 584' ' ' LEU . 48.9 m 64.18 1.3 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.577 0.227 . . . . 0.0 111.471 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 47.5 t . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.934 -179.952 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 112.593 -0.203 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 74.3 p -158.88 81.61 2.68 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.647 0.26 . . . . 0.0 110.924 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 538' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.25 81.5 0.93 Allowed 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.477 2.118 . . . . 0.0 112.447 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -123.75 -45.47 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.308 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -64.48 -62.91 1.3 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.932 0.396 . . . . 0.0 110.552 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -56.82 -45.43 82.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.371 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -55.81 138.41 70.94 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.756 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 543' ' ' PRO . . . . . 0.484 ' HA ' ' CD1' ' A' ' 566' ' ' LEU . 79.3 Cg_endo -89.95 -3.32 5.5 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.83 2.353 . . . . 0.0 113.981 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 544' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -66.9 -40.47 87.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.385 . . . . 0.0 110.622 -179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 545' ' ' VAL . . . . . 0.413 HG12 ' H ' ' A' ' 548' ' ' GLN . 66.3 t -62.68 -45.77 98.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.09 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 546' ' ' ARG . . . . . 0.806 ' HB3' ' HB2' ' A' ' 551' ' ' LEU . 0.0 OUTLIER 78.14 33.77 0.32 Allowed 'General case' 0 N--CA 1.424 -1.728 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 178.342 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 547' ' ' PHE . . . . . 0.615 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.76 31.41 7.48 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 119.419 -0.912 . . . . 0.0 111.533 177.918 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 548' ' ' GLN . . . . . 0.468 ' HA ' HD23 ' A' ' 551' ' ' LEU . 24.4 mt-30 29.15 -82.31 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.499 1.12 . . . . 0.0 113.894 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 549' ' ' GLN . . . . . 0.476 ' N ' ' O ' ' A' ' 547' ' ' PHE . 29.6 mm-40 -72.58 -51.35 20.16 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.839 -177.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 550' ' ' GLN . . . . . 0.615 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 13.2 mp0 -50.88 -38.95 52.71 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.149 0.976 . . . . 0.0 108.538 178.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 551' ' ' LEU . . . . . 0.806 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -59.69 -45.56 91.73 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 114.089 -1.414 . . . . 0.0 109.707 175.487 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 552' ' ' GLU . . . . . 0.609 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 57.3 mt-10 -52.82 -32.73 45.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.117 -178.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 553' ' ' GLN . . . . . . . . . . . . . 8.3 mp0 -76.09 -59.21 2.86 Favored 'General case' 0 C--O 1.245 0.859 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.93 HD13 HD22 ' A' ' 583' ' ' LEU . 14.4 mt -63.28 -28.97 70.39 Favored 'General case' 0 C--N 1.346 0.449 0 C-N-CA 118.591 -1.244 . . . . 0.0 110.234 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 555' ' ' SER . . . . . 0.697 ' HB2' HH22 ' A' ' 546' ' ' ARG . 47.2 t -70.38 -38.19 74.68 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 177.26 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' A' ' 552' ' ' GLU . . . -55.47 -26.38 42.04 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.795 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 557' ' ' MET . . . . . 0.485 ' HG3' HD13 ' A' ' 580' ' ' ILE . 0.0 OUTLIER -86.22 27.53 0.91 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.369 179.002 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 43.09 43.19 5.52 Favored Glycine 0 CA--C 1.523 0.535 0 CA-C-N 115.014 -0.994 . . . . 0.0 113.27 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 559' ' ' PHE . . . . . 0.466 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 1.9 m-85 -77.18 -40.48 45.15 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 27.7 mt 66.19 8.12 5.32 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 178.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 42.5 t-20 -110.97 82.5 1.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.626 0.25 . . . . 0.0 110.519 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 562' ' ' ARG . . . . . 0.534 ' HD3' HH12 ' A' ' 546' ' ' ARG . 19.6 mmt180 -57.05 -31.96 65.72 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.164 0.506 . . . . 0.0 111.443 -178.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.33 -52.67 60.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.56 -179.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -79.52 -25.38 41.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.423 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 565' ' ' ASN . . . . . 0.687 ' O ' HD23 ' A' ' 569' ' ' LEU . 5.4 m120 -60.23 -59.5 5.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.988 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.486 ' HB2' ' CD ' ' A' ' 546' ' ' ARG . 0.3 OUTLIER -66.12 -30.65 71.18 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.502 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -71.12 -33.06 69.77 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 119.23 -0.988 . . . . 0.0 111.642 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 568' ' ' ALA . . . . . 0.525 ' HB3' ' CD1' ' A' ' 554' ' ' LEU . . . -71.51 -28.47 63.92 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 177.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.687 HD23 ' O ' ' A' ' 565' ' ' ASN . 3.3 mm? -72.13 -53.52 12.48 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.975 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 90.0 mt -66.51 -38.51 81.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.552 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -70.42 -17.48 63.01 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.6 p -105.4 -40.87 5.67 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.026 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 92.84 42.1 4.51 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.886 176.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 113.14 -34.94 4.82 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.413 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.17 87.82 0.8 Allowed 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.6 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -77.25 -26.84 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.17 -176.871 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 577' ' ' ASN . . . . . 0.693 ' HA ' HG13 ' A' ' 580' ' ' ILE . 14.7 m-80 -68.53 -53.7 21.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -58.77 -29.65 66.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.053 -1.43 . . . . 0.0 107.632 177.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 579' ' ' ALA . . . . . 0.487 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -75.06 -27.64 60.06 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 114.121 -1.4 . . . . 0.0 110.934 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 580' ' ' ILE . . . . . 0.693 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.5 mt -68.74 -45.26 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.193 0.52 . . . . 0.0 110.398 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 581' ' ' GLU . . . . . 0.793 ' HA ' HD23 ' A' ' 584' ' ' LEU . 36.1 tt0 -68.32 -37.52 80.66 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.814 -178.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 582' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 582' ' ' ARG . 0.0 OUTLIER -76.26 -31.75 58.46 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.965 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 583' ' ' LEU . . . . . 0.93 HD22 HD13 ' A' ' 554' ' ' LEU . 7.5 tp -71.23 -25.67 62.59 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-O 121.306 0.574 . . . . 0.0 109.705 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 584' ' ' LEU . . . . . 0.793 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.1 OUTLIER -86.07 -27.05 24.97 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.597 -179.78 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 130.18 -135.51 8.38 Favored Glycine 0 C--N 1.338 0.669 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.671 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 45.6 t -153.53 -0.77 0.23 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.868 0.366 . . . . 0.0 110.805 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.881 -179.994 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 112.477 -0.249 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 48.3 t 57.03 70.33 1.41 Allowed Pre-proline 0 C--N 1.331 -0.22 0 CA-C-O 120.566 0.222 . . . . 0.0 111.214 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 538' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -64.22 121.3 8.89 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.589 2.193 . . . . 0.0 111.918 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -121.68 -45.63 2.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.582 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -95.85 -13.87 23.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.835 0.35 . . . . 0.0 111.123 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -57.92 -44.07 86.65 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.37 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -52.78 148.73 12.74 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.392 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 543' ' ' PRO . . . . . 0.423 ' HA ' HD13 ' A' ' 566' ' ' LEU . 57.6 Cg_endo -71.51 -8.31 22.99 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.746 2.297 . . . . 0.0 112.542 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 544' ' ' GLU . . . . . 0.507 ' HG3' ' H ' ' A' ' 545' ' ' VAL . 7.2 pt-20 -72.36 -54.05 10.56 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 545' ' ' VAL . . . . . 0.518 HG12 ' H ' ' A' ' 548' ' ' GLN . 64.3 t -66.81 -39.05 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 177.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 546' ' ' ARG . . . . . 0.827 HH11 ' HG3' ' A' ' 546' ' ' ARG . 0.0 OUTLIER 73.09 40.26 0.56 Allowed 'General case' 0 N--CA 1.422 -1.857 0 CA-C-N 114.129 -1.396 . . . . 0.0 113.024 178.232 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 547' ' ' PHE . . . . . 0.576 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 65.92 29.94 10.07 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.134 178.196 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 548' ' ' GLN . . . . . 0.518 ' H ' HG12 ' A' ' 545' ' ' VAL . 2.4 mt-30 30.4 -83.32 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 124.672 1.189 . . . . 0.0 113.953 179.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 549' ' ' GLN . . . . . 0.45 ' N ' ' O ' ' A' ' 547' ' ' PHE . 95.8 mt-30 -72.19 -50.99 23.25 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.221 -177.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 550' ' ' GLN . . . . . 0.784 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 1.8 mp0 -50.87 -33.05 22.3 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 122.579 1.181 . . . . 0.0 108.501 177.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 551' ' ' LEU . . . . . 0.802 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -65.3 -45.08 85.78 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.767 175.488 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 552' ' ' GLU . . . . . 0.57 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 24.4 mm-40 -53.81 -37.76 63.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.136 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 553' ' ' GLN . . . . . 0.702 ' HG3' ' O ' ' A' ' 550' ' ' GLN . 0.0 OUTLIER -72.88 -56.71 4.8 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 120.336 -0.546 . . . . 0.0 112.047 -179.418 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.568 HD11 ' HB3' ' A' ' 568' ' ' ALA . 11.5 mt -58.69 -29.71 66.84 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 118.359 -1.336 . . . . 0.0 110.087 178.476 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 47.2 t -68.95 -40.05 79.18 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -56.66 -27.38 58.49 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.982 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 95.6 mmm -89.94 21.97 3.39 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.708 0.766 . . . . 0.0 109.102 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 47.84 36.79 14.22 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 114.205 -1.361 . . . . 0.0 113.363 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 559' ' ' PHE . . . . . 0.658 ' HB3' HD22 ' A' ' 565' ' ' ASN . 0.3 OUTLIER -61.65 -42.99 99.67 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.546 -0.461 . . . . 0.0 111.672 179.351 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 63.2 mt 63.22 1.94 1.02 Allowed 'General case' 0 C--O 1.232 0.146 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -108.04 85.55 2.14 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 562' ' ' ARG . . . . . 0.41 ' HG2' ' H ' ' A' ' 562' ' ' ARG . 24.7 mmt180 -56.05 -50.76 70.06 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.78 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -47.4 -51.36 20.12 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.271 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.94 -25.22 43.62 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.279 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 565' ' ' ASN . . . . . 0.658 HD22 ' HB3' ' A' ' 559' ' ' PHE . 5.7 m120 -60.44 -59.74 4.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.565 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.631 HD13 ' HA ' ' A' ' 546' ' ' ARG . 2.1 tp -62.04 -29.49 70.32 Favored 'General case' 0 N--CA 1.421 -1.875 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 567' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 571' ' ' ALA . 6.3 tp60 -68.1 -33.98 75.54 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.171 179.099 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 568' ' ' ALA . . . . . 0.568 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -75.94 -43.34 45.38 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.809 0.338 . . . . 0.0 110.913 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.784 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.9 mm? -58.99 -48.56 81.15 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.021 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 84.1 mt -71.78 -40.67 69.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.244 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 571' ' ' ALA . . . . . 0.464 ' HB2' ' O ' ' A' ' 567' ' ' GLN . . . -58.76 -19.45 40.64 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 25.3 p -114.57 -39.92 3.69 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.659 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 89.32 46.44 4.38 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.059 177.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 574' ' ' GLY . . . . . 0.58 ' O ' HG12 ' A' ' 576' ' ' ILE . . . 109.57 -26.97 13.06 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.337 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.55 86.7 0.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.245 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.627 ' O ' HG13 ' A' ' 580' ' ' ILE . 7.2 mm -68.1 -44.77 84.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.204 -176.006 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 577' ' ' ASN . . . . . 0.549 ' HA ' HG13 ' A' ' 580' ' ' ILE . 10.9 m-80 -67.28 -53.58 28.52 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.391 -177.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -57.85 -31.0 66.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.686 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 579' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 583' ' ' LEU . . . -75.31 -29.32 60.0 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.339 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 580' ' ' ILE . . . . . 0.627 HG13 ' O ' ' A' ' 576' ' ' ILE . 1.9 mt -69.4 -47.12 74.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-O 120.971 0.415 . . . . 0.0 111.355 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 581' ' ' GLU . . . . . 0.649 ' HA ' HD23 ' A' ' 584' ' ' LEU . 40.8 tt0 -69.69 -38.48 77.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.528 -178.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 582' ' ' ARG . . . . . 0.628 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -75.23 -32.15 61.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.583 -179.092 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 583' ' ' LEU . . . . . 0.628 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 8.9 tp -71.69 -32.0 67.36 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.721 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 584' ' ' LEU . . . . . 0.649 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER -83.9 -15.35 48.35 Favored 'General case' 0 N--CA 1.409 -2.479 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.0 -83.96 0.13 Allowed Glycine 0 C--N 1.337 0.599 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.565 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 35.2 t -65.93 174.61 2.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.764 0.316 . . . . 0.0 110.976 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 46.7 t . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.794 -179.981 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 112.559 -0.216 . . . . 0.0 112.559 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 537' ' ' SER . . . . . 0.587 ' HB2' ' HD3' ' A' ' 538' ' ' PRO . 69.3 m -65.97 -49.78 55.88 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 538' ' ' PRO . . . . . 0.587 ' HD3' ' HB2' ' A' ' 537' ' ' SER . 37.8 Cg_exo -60.99 95.09 0.11 Allowed 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.049 1.833 . . . . 0.0 112.109 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -50.31 78.16 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.315 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 540' ' ' PHE . . . . . 0.518 ' N ' ' O ' ' A' ' 538' ' ' PRO . 52.2 p90 -69.77 -6.07 29.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.717 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -56.16 -45.81 79.54 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 17.2 p-10 -133.05 75.31 72.06 Favored Pre-proline 0 C--N 1.331 -0.212 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 543' ' ' PRO . . . . . 0.477 ' O ' ' HG2' ' A' ' 546' ' ' ARG . 96.3 Cg_endo -98.13 -9.79 0.55 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 123.331 2.687 . . . . 0.0 111.642 178.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 544' ' ' GLU . . . . . 0.548 ' HG3' ' H ' ' A' ' 545' ' ' VAL . 7.0 pt-20 -74.81 -55.13 6.14 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.819 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 545' ' ' VAL . . . . . 0.622 HG13 ' HG3' ' A' ' 548' ' ' GLN . 89.2 t -65.24 -44.02 95.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-N 115.285 -0.871 . . . . 0.0 108.999 178.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 546' ' ' ARG . . . . . 0.679 HH22 ' HA ' ' A' ' 551' ' ' LEU . 0.0 OUTLIER 59.56 40.04 20.8 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.736 -179.983 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 547' ' ' PHE . . . . . 0.57 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.9 15.52 10.16 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 119.302 -0.959 . . . . 0.0 109.432 -179.183 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 548' ' ' GLN . . . . . 0.622 ' HG3' HG13 ' A' ' 545' ' ' VAL . 1.5 mt-30 34.69 -79.6 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.777 177.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 549' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 547' ' ' PHE . 95.5 mt-30 -72.07 -51.9 19.41 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.071 -177.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 550' ' ' GLN . . . . . 0.638 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 1.8 mp0 -52.45 -40.49 62.33 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 115.526 -0.761 . . . . 0.0 108.991 177.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 551' ' ' LEU . . . . . 0.679 ' HA ' HH22 ' A' ' 546' ' ' ARG . 0.1 OUTLIER -60.01 -45.55 92.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.138 176.813 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 552' ' ' GLU . . . . . 0.611 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 10.1 mm-40 -53.73 -31.8 49.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.605 -179.233 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 553' ' ' GLN . . . . . 0.608 ' HB3' HG21 ' A' ' 576' ' ' ILE . 45.8 mt-30 -75.78 -59.02 2.94 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.577 HD13 ' CE2' ' A' ' 559' ' ' PHE . 10.9 mt -60.68 -30.37 69.88 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 119.681 1.128 . . . . 0.0 110.041 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 555' ' ' SER . . . . . 0.482 ' OG ' HD12 ' A' ' 551' ' ' LEU . 46.7 m -70.26 -42.05 72.66 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -56.48 -22.03 29.72 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.935 178.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 87.9 mmm -95.53 22.09 7.46 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.181 0.515 . . . . 0.0 110.408 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 55.43 46.33 80.89 Favored Glycine 0 CA--C 1.52 0.372 0 CA-C-N 115.492 -0.776 . . . . 0.0 113.318 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 559' ' ' PHE . . . . . 0.651 ' CE2' ' HG ' ' A' ' 583' ' ' LEU . 0.6 OUTLIER -65.7 -42.69 90.88 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.722 0.261 . . . . 0.0 111.473 179.475 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 57.2 mt 75.42 11.35 3.37 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 176.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.432 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 41.3 t-20 -146.14 95.87 2.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.834 0.35 . . . . 0.0 110.288 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 562' ' ' ARG . . . . . 0.575 ' HA ' ' ND2' ' A' ' 565' ' ' ASN . 22.9 mmt180 -57.14 -58.52 7.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.89 -178.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -53.63 -33.31 54.68 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.816 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 564' ' ' ALA . . . . . 0.432 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -75.71 -24.41 56.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.374 -178.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 565' ' ' ASN . . . . . 0.679 ' HB2' ' CZ ' ' A' ' 546' ' ' ARG . 16.8 m-20 -70.84 -50.91 30.26 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.643 ' HB2' ' NE ' ' A' ' 546' ' ' ARG . 1.0 OUTLIER -51.73 -48.1 63.76 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -54.42 -46.23 73.16 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.735 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 568' ' ' ALA . . . . . 0.542 ' HB1' ' HB1' ' A' ' 579' ' ' ALA . . . -67.34 -41.66 84.84 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 111.619 0.229 . . . . 0.0 111.619 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.743 HD11 HD11 ' A' ' 576' ' ' ILE . 3.5 mm? -63.44 -42.56 98.67 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 120.843 0.354 . . . . 0.0 111.921 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 30.7 mm -64.44 -35.13 73.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.173 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -87.53 -17.12 32.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.105 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 572' ' ' THR . . . . . 0.608 ' HB ' ' HB3' ' A' ' 575' ' ' ASP . 76.4 p -106.43 0.82 25.11 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 53.7 30.73 44.14 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.931 -0.652 . . . . 0.0 113.773 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 102.52 -2.16 49.69 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.891 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 575' ' ' ASP . . . . . 0.608 ' HB3' ' HB ' ' A' ' 572' ' ' THR . 2.6 t0 -77.75 77.73 4.26 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.743 HD11 HD11 ' A' ' 569' ' ' LEU . 10.4 mm -58.18 -35.08 51.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.941 -177.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 577' ' ' ASN . . . . . 0.633 ' HA ' HG13 ' A' ' 580' ' ' ILE . 5.9 m-80 -67.76 -45.14 75.77 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.036 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 578' ' ' ALA . . . . . 0.51 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -61.88 -34.49 76.11 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.502 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 579' ' ' ALA . . . . . 0.542 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -71.83 -30.98 66.06 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.893 -1.048 . . . . 0.0 110.915 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 580' ' ' ILE . . . . . 0.633 HG13 ' HA ' ' A' ' 577' ' ' ASN . 3.5 mt -61.1 -56.82 15.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.616 0 CA-C-O 121.364 0.602 . . . . 0.0 110.839 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -65.36 -29.66 70.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.116 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 582' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 578' ' ' ALA . 1.1 ttt180 -77.13 -47.64 19.87 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 583' ' ' LEU . . . . . 0.651 ' HG ' ' CE2' ' A' ' 559' ' ' PHE . 3.3 tm? -53.49 -58.04 8.56 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-O 121.212 0.529 . . . . 0.0 110.938 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 584' ' ' LEU . . . . . . . . . . . . . 3.5 mt -79.46 -3.41 46.47 Favored 'General case' 0 N--CA 1.394 -3.245 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.178 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -94.52 -99.11 1.65 Allowed Glycine 0 C--N 1.342 0.877 0 C-N-CA 120.514 -0.85 . . . . 0.0 112.711 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 32.7 m 69.71 1.49 3.42 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 122.38 0.272 . . . . 0.0 111.292 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 49.5 m . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.331 -0.842 . . . . 0.0 111.159 179.912 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.259 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 537' ' ' SER . . . . . 0.675 ' H ' ' HD2' ' A' ' 538' ' ' PRO . 43.4 t -162.47 -52.71 0.01 OUTLIER Pre-proline 0 CA--C 1.533 0.325 0 N-CA-C 111.238 0.088 . . . . 0.0 111.238 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 538' ' ' PRO . . . . . 0.675 ' HD2' ' H ' ' A' ' 537' ' ' SER . 55.4 Cg_endo -69.85 -35.42 12.43 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.885 1.723 . . . . 0.0 112.202 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 49.82 104.16 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.531 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -99.64 -7.95 25.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.886 0.374 . . . . 0.0 110.373 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -60.33 -25.99 66.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.09 -179.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 542' ' ' ASN . . . . . 0.64 ' HB3' ' HD2' ' A' ' 543' ' ' PRO . 4.6 m-20 -60.35 178.12 0.27 Allowed Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.052 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 543' ' ' PRO . . . . . 0.64 ' HD2' ' HB3' ' A' ' 542' ' ' ASN . 86.1 Cg_exo -48.27 -13.46 0.24 Allowed 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 121.894 1.729 . . . . 0.0 111.504 177.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 544' ' ' GLU . . . . . 0.454 ' H ' ' C ' ' A' ' 542' ' ' ASN . 40.3 mt-10 -53.89 -25.74 21.55 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 113.854 -1.521 . . . . 0.0 108.097 178.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 545' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 542' ' ' ASN . 77.9 t -54.53 -57.41 6.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 114.295 -1.32 . . . . 0.0 109.086 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 546' ' ' ARG . . . . . 0.73 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 10.4 mmt180 -116.95 127.2 53.98 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.461 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 547' ' ' PHE . . . . . 0.673 ' HB2' ' HG ' ' A' ' 566' ' ' LEU . 0.1 OUTLIER 32.4 37.85 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 176.712 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 548' ' ' GLN . . . . . 0.69 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 4.7 pt20 23.87 -84.12 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.299 1.04 . . . . 0.0 113.631 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 549' ' ' GLN . . . . . 0.69 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 29.8 pt20 -73.76 -50.33 21.16 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.635 -177.004 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 550' ' ' GLN . . . . . 0.771 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 1.3 mm100 -50.09 -44.09 51.76 Favored 'General case' 0 C--O 1.25 1.082 0 CA-C-O 121.654 0.74 . . . . 0.0 111.541 -178.35 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 551' ' ' LEU . . . . . 0.73 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -72.64 -34.27 67.18 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.6 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -52.17 -32.24 35.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 553' ' ' GLN . . . . . 0.426 ' O ' ' HB3' ' A' ' 556' ' ' ALA . 1.2 mp0 -74.39 -58.53 3.23 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.02 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.941 HD13 HD22 ' A' ' 583' ' ' LEU . 12.5 mt -60.38 -29.29 68.84 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 118.59 -1.244 . . . . 0.0 110.775 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 555' ' ' SER . . . . . 0.436 ' HB2' ' CD1' ' A' ' 551' ' ' LEU . 25.3 t -70.18 -37.4 75.13 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 553' ' ' GLN . . . -55.14 -27.98 49.38 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.794 178.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 557' ' ' MET . . . . . 0.466 ' SD ' ' O ' ' A' ' 557' ' ' MET . 0.0 OUTLIER -81.73 19.51 1.06 Allowed 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 122.586 1.184 . . . . 0.0 109.111 178.642 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 558' ' ' GLY . . . . . 0.424 ' H ' ' C ' ' A' ' 556' ' ' ALA . . . 52.81 48.97 56.08 Favored Glycine 0 CA--C 1.524 0.61 0 CA-C-N 114.723 -1.126 . . . . 0.0 113.57 -178.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 559' ' ' PHE . . . . . 0.569 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 0.8 OUTLIER -74.86 -36.82 62.32 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 179.481 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 560' ' ' LEU . . . . . 0.544 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 56.5 mt 74.0 3.54 4.44 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 178.025 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -125.6 95.54 4.48 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 562' ' ' ARG . . . . . 0.509 ' HB2' ' HE ' ' A' ' 546' ' ' ARG . 8.2 mmm180 -60.2 -63.15 1.4 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.374 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -50.17 -38.58 40.33 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.143 0.497 . . . . 0.0 111.934 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -68.73 -24.96 64.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.779 -178.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 565' ' ' ASN . . . . . 0.728 ' O ' HD23 ' A' ' 569' ' ' LEU . 7.9 m120 -80.26 -51.17 9.24 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 566' ' ' LEU . . . . . 0.721 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.5 OUTLIER -51.5 -36.45 44.68 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -177.925 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -68.57 -42.84 77.73 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.564 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 568' ' ' ALA . . . . . 0.524 ' HB1' ' HB1' ' A' ' 579' ' ' ALA . . . -61.53 -28.35 69.26 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.763 176.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.771 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 4.3 mm? -72.54 -52.08 17.18 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.47 -178.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 89.1 mt -67.8 -39.5 82.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.175 0.512 . . . . 0.0 109.779 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -63.19 -19.64 64.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.564 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 572' ' ' THR . . . . . 0.413 HG21 ' HB2' ' A' ' 579' ' ' ALA . 34.6 p -108.23 -39.57 5.43 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 119.739 -0.785 . . . . 0.0 110.31 179.255 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 91.07 39.77 5.67 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.859 -0.686 . . . . 0.0 113.179 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 114.93 -30.18 6.99 Favored Glycine 0 C--N 1.333 0.391 0 C-N-CA 120.32 -0.943 . . . . 0.0 112.676 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -75.89 85.94 2.84 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 576' ' ' ILE . . . . . 0.602 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -73.99 -28.14 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.664 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.931 -177.244 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 577' ' ' ASN . . . . . 0.661 ' HA ' HG13 ' A' ' 580' ' ' ILE . 14.7 m-80 -68.73 -53.28 22.95 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 124.257 0.973 . . . . 0.0 108.722 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -60.08 -30.04 68.97 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.258 -1.337 . . . . 0.0 107.756 177.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 579' ' ' ALA . . . . . 0.524 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -74.25 -28.89 61.44 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.777 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 580' ' ' ILE . . . . . 0.661 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.2 mt -67.01 -42.38 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-O 121.302 0.572 . . . . 0.0 110.286 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 581' ' ' GLU . . . . . 0.637 ' HA ' HD23 ' A' ' 584' ' ' LEU . 37.7 tt0 -69.89 -40.49 75.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.826 -178.283 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 582' ' ' ARG . . . . . 0.632 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -76.32 -35.14 58.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.148 -178.554 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 583' ' ' LEU . . . . . 0.941 HD22 HD13 ' A' ' 554' ' ' LEU . 13.4 tp -71.45 -32.24 68.1 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-O 121.072 0.463 . . . . 0.0 110.371 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 584' ' ' LEU . . . . . 0.637 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER -83.91 -16.87 42.7 Favored 'General case' 0 N--CA 1.41 -2.43 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.489 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -99.43 -0.68 56.78 Favored Glycine 0 C--N 1.338 0.663 0 CA-C-N 114.745 -1.116 . . . . 0.0 112.385 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 9.8 t -77.26 -157.48 0.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.58 0.229 . . . . 0.0 110.588 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 60.6 m . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.858 179.91 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 546' ' ' ARG . . . . . 0.687 ' HA ' ' HB2' ' A' ' 566' ' ' LEU . 5.8 mtm180 . . . . . 0 N--CA 1.436 -1.168 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 547' ' ' PHE . . . . . 0.676 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 63.99 18.23 11.08 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 -177.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 548' ' ' GLN . . . . . 0.472 ' HA ' HD23 ' A' ' 551' ' ' LEU . 1.8 mt-30 29.89 -78.7 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 113.773 -1.558 . . . . 0.0 114.133 177.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 549' ' ' GLN . . . . . 0.558 ' O ' ' HB3' ' A' ' 552' ' ' GLU . 15.0 mm100 -71.4 -50.82 28.15 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.425 -177.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 550' ' ' GLN . . . . . 0.796 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 4.1 mm100 -52.09 -40.67 61.58 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.088 -0.96 . . . . 0.0 108.874 178.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 551' ' ' LEU . . . . . 0.548 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -62.63 -40.74 97.96 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.724 177.706 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . 0.558 ' HB3' ' O ' ' A' ' 549' ' ' GLN . 5.1 tp10 -53.59 -32.12 49.73 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.55 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 553' ' ' GLN . . . . . 0.476 ' NE2' ' HA ' ' A' ' 550' ' ' GLN . 0.4 OUTLIER -77.39 -58.46 3.26 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 118.826 -0.607 . . . . 0.0 112.614 179.611 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.655 HD13 HD22 ' A' ' 583' ' ' LEU . 10.9 mt -57.85 -32.43 67.63 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 120.43 1.468 . . . . 0.0 110.369 178.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . 0.427 ' HB2' HD12 ' A' ' 551' ' ' LEU . 44.9 t -68.9 -40.16 79.3 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -55.35 -27.17 45.51 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.503 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 557' ' ' MET . . . . . 0.715 ' HG3' HD13 ' A' ' 580' ' ' ILE . 26.5 mmm -89.31 24.98 2.03 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.898 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 75.56 39.94 33.68 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 115.416 0.926 . . . . 0.0 115.416 178.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 559' ' ' PHE . . . . . 0.498 ' HB2' ' O ' ' A' ' 554' ' ' LEU . 10.3 m-85 -104.44 126.89 51.95 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 118.189 0.995 . . . . 0.0 110.662 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 87.9 mt -96.31 -18.85 19.69 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -77.18 82.2 3.67 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 562' ' ' ARG . . . . . 0.604 ' HA ' ' ND2' ' A' ' 565' ' ' ASN . 15.6 mmt180 -59.89 -53.54 56.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.791 -177.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -52.33 -31.85 35.2 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.457 0.646 . . . . 0.0 110.794 178.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -73.47 -23.24 60.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.012 -178.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.793 ' O ' HD23 ' A' ' 569' ' ' LEU . 14.8 m-20 -78.65 -47.8 16.32 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.687 ' HB2' ' HA ' ' A' ' 546' ' ' ARG . 0.6 OUTLIER -52.48 -47.92 66.23 Favored 'General case' 0 N--CA 1.42 -1.926 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -72.34 -38.12 68.69 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.981 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 568' ' ' ALA . . . . . 0.412 ' HB3' ' CD1' ' A' ' 554' ' ' LEU . . . -60.39 -31.89 70.79 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 118.93 -1.108 . . . . 0.0 108.424 178.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.796 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 4.0 mm? -73.84 -37.43 64.82 Favored 'General case' 0 N--CA 1.428 -1.561 0 CA-C-O 120.893 0.377 . . . . 0.0 111.818 -178.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 22.7 mm -65.43 -38.6 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.778 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -81.13 -15.53 55.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.394 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . 0.592 HG21 ' HB2' ' A' ' 579' ' ' ALA . 39.6 p -104.86 4.59 32.23 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 47.4 32.01 7.05 Favored Glycine 0 C--N 1.337 0.585 0 N-CA-C 115.027 0.771 . . . . 0.0 115.027 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 574' ' ' GLY . . . . . 0.436 ' HA2' ' NE2' ' A' ' 550' ' ' GLN . . . 108.1 -17.46 34.85 Favored Glycine 0 C--O 1.229 -0.178 0 C-N-CA 120.078 -1.058 . . . . 0.0 113.212 179.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 575' ' ' ASP . . . . . 0.479 ' HB3' ' HB3' ' A' ' 578' ' ' ALA . 3.3 m-20 -75.27 78.82 2.37 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.684 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -67.54 -33.86 64.77 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.976 -177.079 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 577' ' ' ASN . . . . . 0.57 ' HA ' HG13 ' A' ' 580' ' ' ILE . 1.0 OUTLIER -66.29 -46.68 76.15 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 124.334 1.021 . . . . 0.0 108.697 179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 578' ' ' ALA . . . . . 0.479 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -62.55 -31.04 71.76 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.981 -1.463 . . . . 0.0 107.742 177.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 579' ' ' ALA . . . . . 0.592 ' HB2' HG21 ' A' ' 572' ' ' THR . . . -74.26 -33.9 63.44 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.271 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 580' ' ' ILE . . . . . 0.715 HD13 ' HG3' ' A' ' 557' ' ' MET . 3.7 mt -62.78 -44.02 99.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 121.444 0.64 . . . . 0.0 110.431 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . 0.444 ' HA ' HD23 ' A' ' 584' ' ' LEU . 39.7 mt-10 -68.94 -39.17 79.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.711 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 582' ' ' ARG . . . . . . . . . . . . . 2.2 ttt85 -77.44 -40.8 42.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.406 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 583' ' ' LEU . . . . . 0.655 HD22 HD13 ' A' ' 554' ' ' LEU . 8.2 tp -62.52 -44.58 96.01 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.624 -177.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 584' ' ' LEU . . . . . 0.504 ' O ' HD12 ' A' ' 584' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.42 -1.972 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 546' ' ' ARG . . . . . 0.601 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 6.3 mtm180 . . . . . 0 N--CA 1.439 -0.98 0 CA-C-O 120.96 0.41 . . . . 0.0 110.284 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 547' ' ' PHE . . . . . 0.564 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 59.34 22.6 10.99 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 -178.13 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 548' ' ' GLN . . . . . 0.728 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.9 pt20 29.42 -79.16 0.0 OUTLIER 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.516 1.527 . . . . 0.0 114.325 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 549' ' ' GLN . . . . . 0.728 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 24.6 mt-30 -71.7 -49.84 35.79 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.752 0.787 . . . . 0.0 111.006 -177.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 550' ' ' GLN . . . . . 0.633 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 11.2 mp0 -52.28 -40.33 61.63 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.345 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 551' ' ' LEU . . . . . 0.601 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -60.22 -40.23 89.43 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.749 176.684 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . 0.523 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 42.1 mt-10 -53.33 -32.35 48.62 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.752 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 553' ' ' GLN . . . . . 0.454 ' CD ' HD12 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -78.29 -59.02 2.95 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 118.925 -0.56 . . . . 0.0 112.057 179.667 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.586 HD12 HD23 ' A' ' 569' ' ' LEU . 8.1 mt -54.28 -33.02 57.75 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 120.092 1.315 . . . . 0.0 110.992 177.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . 0.418 ' HB2' HD12 ' A' ' 551' ' ' LEU . 48.4 t -69.91 -39.8 75.99 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.35 -33.46 59.09 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 43.1 mmm -97.58 22.09 9.42 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.177 0.898 . . . . 0.0 111.077 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . 0.413 ' O ' ' O ' ' A' ' 559' ' ' PHE . . . 117.14 -118.85 4.26 Favored Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 559' ' ' PHE . . . . . 0.449 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 90.4 m-85 29.85 112.01 0.0 OUTLIER 'General case' 0 C--O 1.232 0.139 0 N-CA-C 116.018 1.859 . . . . 0.0 116.018 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 68.3 mt -107.83 8.92 28.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.533 178.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.578 ' HB2' ' HB3' ' A' ' 564' ' ' ALA . 0.3 OUTLIER -87.9 105.75 17.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.136 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 562' ' ' ARG . . . . . 0.569 ' HD2' ' HD3' ' A' ' 546' ' ' ARG . 24.2 mmt180 -59.6 -68.75 0.25 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.555 -178.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -32.11 31.15 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.217 -179.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 564' ' ' ALA . . . . . 0.578 ' HB3' ' HB2' ' A' ' 561' ' ' ASN . . . -76.76 -24.72 52.96 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -177.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.599 ' O ' HD23 ' A' ' 569' ' ' LEU . 86.1 m-20 -78.68 -49.84 12.45 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 120.816 0.341 . . . . 0.0 110.61 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.541 HD12 ' N ' ' A' ' 547' ' ' PHE . 1.1 tp -57.31 -45.77 83.88 Favored 'General case' 0 N--CA 1.421 -1.883 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.139 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -71.94 -40.22 68.88 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 568' ' ' ALA . . . . . 0.582 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -57.29 -30.32 64.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.21 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.633 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.3 mm? -72.68 -34.93 67.54 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.496 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 570' ' ' ILE . . . . . 0.425 HD13 ' HE2' ' A' ' 547' ' ' PHE . 39.1 mm -73.86 -42.1 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-O 121.474 0.654 . . . . 0.0 109.246 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -57.62 -29.21 64.34 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.726 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 32.0 p -99.37 -38.73 8.72 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.766 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 93.88 27.47 12.53 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.891 -0.671 . . . . 0.0 113.227 177.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 126.28 -33.04 3.58 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.49 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.8 79.64 1.13 Allowed 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.637 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -64.83 -36.09 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.927 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.12 -176.819 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 577' ' ' ASN . . . . . 0.587 ' HA ' HG13 ' A' ' 580' ' ' ILE . 1.0 OUTLIER -65.22 -40.2 93.8 Favored 'General case' 0 N--CA 1.442 -0.834 0 O-C-N 124.324 1.015 . . . . 0.0 108.501 179.223 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -66.59 -33.26 75.28 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.027 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 579' ' ' ALA . . . . . 0.526 ' HA ' ' HG2' ' A' ' 582' ' ' ARG . . . -73.51 -33.64 64.87 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.855 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 580' ' ' ILE . . . . . 0.637 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.8 mt -61.62 -48.67 87.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 121.494 0.664 . . . . 0.0 110.599 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . 0.567 ' HA ' HD23 ' A' ' 584' ' ' LEU . 37.4 tt0 -67.67 -36.83 81.44 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.895 -178.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 582' ' ' ARG . . . . . 0.64 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -77.87 -38.98 44.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.183 0.516 . . . . 0.0 110.647 -179.199 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 583' ' ' LEU . . . . . 0.64 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 11.2 tp -63.91 -40.41 96.43 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 123.674 0.79 . . . . 0.0 110.878 -178.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 584' ' ' LEU . . . . . 0.567 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.419 -2.021 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 546' ' ' ARG . . . . . 0.801 ' NH1' HD22 ' A' ' 565' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.421 -1.921 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 547' ' ' PHE . . . . . 0.583 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.08 28.69 10.25 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 119.322 -0.951 . . . . 0.0 109.713 178.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 548' ' ' GLN . . . . . 0.717 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 6.5 pt20 28.16 -81.6 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 125.004 1.322 . . . . 0.0 114.228 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 549' ' ' GLN . . . . . 0.717 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 3.7 pt20 -73.34 -50.07 23.95 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.334 -178.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 550' ' ' GLN . . . . . 0.702 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 11.9 mp0 -50.11 -36.26 29.01 Favored 'General case' 0 C--O 1.245 0.843 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 177.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 551' ' ' LEU . . . . . 0.749 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -62.68 -45.15 94.13 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 114.137 -1.392 . . . . 0.0 109.928 177.0 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . 0.59 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 14.6 mm-40 -52.87 -32.09 42.97 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.362 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 553' ' ' GLN . . . . . 0.629 ' HG3' HD12 ' A' ' 576' ' ' ILE . 8.5 mm-40 -73.61 -60.24 2.34 Favored 'General case' 0 C--O 1.246 0.894 0 N-CA-C 112.424 0.528 . . . . 0.0 112.424 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.938 HD13 HD22 ' A' ' 583' ' ' LEU . 11.6 mt -62.91 -29.86 71.1 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.535 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . 0.566 ' HB2' HD12 ' A' ' 551' ' ' LEU . 46.7 t -69.73 -38.47 76.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -55.91 -26.58 48.21 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.434 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 557' ' ' MET . . . . . 0.618 ' HG3' HD13 ' A' ' 580' ' ' ILE . 84.8 mmm -87.34 25.32 1.42 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.317 0.58 . . . . 0.0 110.138 178.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 44.31 44.15 7.73 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-N 114.728 -1.124 . . . . 0.0 113.633 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 559' ' ' PHE . . . . . 0.486 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 1.6 m-85 -76.11 -41.96 48.6 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 113.353 0.872 . . . . 0.0 113.353 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 23.4 mt 66.28 7.15 4.68 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 178.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.428 ' C ' HD22 ' A' ' 561' ' ' ASN . 0.2 OUTLIER -108.98 79.56 1.23 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 179.398 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 562' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 562' ' ' ARG . 7.1 mmt180 -58.65 -29.07 66.26 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.59 -178.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -65.16 -51.84 58.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.075 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 564' ' ' ALA . . . . . 0.41 ' H ' ' ND2' ' A' ' 561' ' ' ASN . . . -78.81 -25.1 44.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.253 -178.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.801 HD22 ' NH1' ' A' ' 546' ' ' ARG . 90.0 m-20 -60.8 -58.02 10.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.781 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.648 HD13 ' HA ' ' A' ' 546' ' ' ARG . 2.1 tp -63.82 -30.95 71.99 Favored 'General case' 0 N--CA 1.424 -1.751 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -69.9 -32.01 70.1 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.385 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 568' ' ' ALA . . . . . 0.651 ' HB1' ' HB1' ' A' ' 579' ' ' ALA . . . -77.36 -38.91 49.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.859 0.362 . . . . 0.0 110.768 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.702 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.9 mm? -64.05 -49.56 71.87 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.224 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 83.4 mt -70.07 -39.74 77.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.259 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -67.96 -15.33 63.56 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 48.7 p -108.13 -40.89 5.07 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 119.756 -0.778 . . . . 0.0 110.324 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 94.42 43.45 3.71 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.378 -0.915 . . . . 0.0 112.652 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 110.84 -33.42 5.91 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.343 -0.932 . . . . 0.0 112.271 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.96 87.51 1.33 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.629 HD12 ' HG3' ' A' ' 553' ' ' GLN . 0.6 OUTLIER -77.62 -27.0 15.28 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.425 -176.836 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 577' ' ' ASN . . . . . 0.683 ' HA ' HG13 ' A' ' 580' ' ' ILE . 0.9 OUTLIER -68.84 -53.64 20.27 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.867 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -58.44 -29.87 66.49 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.249 -1.341 . . . . 0.0 107.76 176.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 579' ' ' ALA . . . . . 0.651 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -74.82 -27.44 60.29 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.12 -1.4 . . . . 0.0 110.929 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 580' ' ' ILE . . . . . 0.683 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.3 mt -69.51 -43.42 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 121.081 0.467 . . . . 0.0 110.604 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . 0.673 ' HA ' HD23 ' A' ' 584' ' ' LEU . 41.6 tt0 -69.49 -38.02 77.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.217 -178.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 582' ' ' ARG . . . . . 0.65 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -75.41 -32.12 60.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.497 -179.335 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 583' ' ' LEU . . . . . 0.938 HD22 HD13 ' A' ' 554' ' ' LEU . 8.1 tp -72.14 -31.89 66.41 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.79 -178.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 584' ' ' LEU . . . . . 0.673 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.408 -2.531 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 546' ' ' ARG . . . . . 0.665 ' HA ' HD12 ' A' ' 566' ' ' LEU . 2.2 ptt180 . . . . . 0 CA--C 1.513 -0.446 0 CA-C-O 121.79 0.805 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 547' ' ' PHE . . . . . 0.587 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 60.38 18.63 8.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.043 179.02 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 548' ' ' GLN . . . . . 0.717 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.8 pt20 28.29 -76.17 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 177.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 549' ' ' GLN . . . . . 0.717 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 12.4 mm100 -72.21 -50.81 24.59 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.559 0.695 . . . . 0.0 110.897 -178.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 550' ' ' GLN . . . . . 0.587 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 10.9 mp0 -53.93 -42.18 68.54 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 551' ' ' LEU . . . . . 0.659 HD22 ' CG ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -56.5 -40.84 75.65 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.24 176.167 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . 0.598 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 14.3 tt0 -55.4 -32.54 62.73 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.443 -179.091 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 553' ' ' GLN . . . . . 0.504 ' HB3' HG21 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -74.28 -58.18 3.46 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.293 179.347 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.653 HD11 ' HB3' ' A' ' 568' ' ' ALA . 7.9 mt -55.81 -29.85 60.41 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.485 177.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 44.0 t -70.26 -39.36 75.04 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 553' ' ' GLN . . . -54.26 -35.14 62.2 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.467 -0.788 . . . . 0.0 113.084 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 10.8 mtp -97.97 21.37 10.76 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.006 0.821 . . . . 0.0 110.801 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 119.53 -118.49 3.96 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.751 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 559' ' ' PHE . . . . . 0.402 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 83.9 m-85 28.39 108.35 0.0 OUTLIER 'General case' 0 C--O 1.232 0.17 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.5 12.38 29.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 113.91 -1.495 . . . . 0.0 108.86 178.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.472 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 49.5 t-20 -97.78 109.34 22.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.684 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 562' ' ' ARG . . . . . 0.619 ' HB3' ' HD2' ' A' ' 546' ' ' ARG . 27.0 mmt180 -59.33 -61.8 2.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.158 -178.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -35.52 64.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.214 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 564' ' ' ALA . . . . . 0.472 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -77.58 -25.73 50.2 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -177.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.545 ' O ' HD23 ' A' ' 569' ' ' LEU . 78.0 m-20 -71.53 -55.62 7.48 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.441 -0.504 . . . . 0.0 109.929 -179.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.665 HD12 ' HA ' ' A' ' 546' ' ' ARG . 0.3 OUTLIER -55.98 -46.0 78.78 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.248 -179.567 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 567' ' ' GLN . . . . . 0.62 HE21 ' HA ' ' A' ' 567' ' ' GLN . 0.0 OUTLIER -61.21 -42.21 98.19 Favored 'General case' 0 CA--C 1.504 -0.826 0 C-N-CA 119.359 -0.936 . . . . 0.0 112.93 -178.209 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 568' ' ' ALA . . . . . 0.653 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -62.12 -28.41 69.62 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 118.857 -1.137 . . . . 0.0 108.295 177.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.64 HD11 HD13 ' A' ' 576' ' ' ILE . 3.0 mm? -73.11 -42.97 62.36 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 41.5 mm -72.55 -36.97 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 571' ' ' ALA . . . . . 0.533 ' HB1' HH12 ' A' ' 582' ' ' ARG . . . -57.03 -32.32 66.06 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.959 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 33.9 p -100.18 -38.56 8.46 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.402 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 94.15 27.74 11.78 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.006 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 127.9 -31.78 3.62 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.419 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -75.48 77.46 2.52 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.651 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.6 OUTLIER -63.95 -37.25 79.28 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.811 0 CA-C-N 114.775 -1.102 . . . . 0.0 111.243 -176.598 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 577' ' ' ASN . . . . . 0.525 ' HA ' HG13 ' A' ' 580' ' ' ILE . 7.8 m-80 -63.97 -42.37 97.27 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 124.207 0.942 . . . . 0.0 108.848 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 578' ' ' ALA . . . . . 0.436 ' O ' ' HD2' ' A' ' 582' ' ' ARG . . . -64.41 -39.5 93.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 113.969 -1.469 . . . . 0.0 107.605 177.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 579' ' ' ALA . . . . . 0.696 ' HA ' ' HD3' ' A' ' 582' ' ' ARG . . . -64.12 -35.43 80.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 114.4 -1.273 . . . . 0.0 110.503 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 580' ' ' ILE . . . . . 0.651 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.4 mt -63.4 -37.16 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 CA-C-O 121.205 0.526 . . . . 0.0 110.124 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -66.63 -44.4 82.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.326 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 582' ' ' ARG . . . . . 0.696 ' HD3' ' HA ' ' A' ' 579' ' ' ALA . 0.0 OUTLIER -80.46 -41.07 25.06 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.581 -0.447 . . . . 0.0 111.339 -178.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 583' ' ' LEU . . . . . 0.48 ' HB3' ' O ' ' A' ' 579' ' ' ALA . 12.8 tp -58.07 -42.04 84.7 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.703 -178.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 584' ' ' LEU . . . . . 0.488 ' HB3' ' O ' ' A' ' 580' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.412 -2.349 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 177.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 546' ' ' ARG . . . . . 0.774 ' HD2' HD22 ' A' ' 551' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.52 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 547' ' ' PHE . . . . . 0.627 ' HD2' HD23 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 22.95 37.37 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.224 1.564 . . . . 0.0 115.224 172.774 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 548' ' ' GLN . . . . . 0.693 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.9 pt20 28.31 -86.24 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 549' ' ' GLN . . . . . 0.693 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 25.7 mt-30 -73.33 -51.5 17.24 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.225 -177.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 550' ' ' GLN . . . . . 0.534 ' HB3' ' CD1' ' A' ' 569' ' ' LEU . 2.5 mp0 -51.36 -42.24 61.19 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-O 121.441 0.639 . . . . 0.0 110.759 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 551' ' ' LEU . . . . . 0.774 HD22 ' HD2' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -63.09 -39.21 94.05 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.353 177.685 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . 0.541 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 12.5 tt0 -51.78 -31.93 29.0 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.331 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 553' ' ' GLN . . . . . 0.56 ' HG2' HD12 ' A' ' 576' ' ' ILE . 1.7 mp0 -75.33 -58.84 3.04 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.755 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.649 HD13 HD22 ' A' ' 583' ' ' LEU . 8.4 mt -55.1 -36.99 66.26 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 119.111 -1.036 . . . . 0.0 111.506 178.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 4.9 m -67.92 -37.34 81.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 553' ' ' GLN . . . -53.97 -34.89 61.01 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.716 -0.675 . . . . 0.0 112.803 179.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 557' ' ' MET . . . . . 0.617 ' HG3' HG21 ' A' ' 580' ' ' ILE . 40.7 mmm -83.28 28.39 0.53 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.08 0.855 . . . . 0.0 111.786 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 74.44 40.84 38.66 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 115.361 0.904 . . . . 0.0 115.361 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -113.33 134.19 54.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 117.551 0.676 . . . . 0.0 109.943 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 93.5 mt -111.51 -1.04 15.99 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -178.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.716 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 0.2 OUTLIER -81.75 102.64 10.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.148 0.499 . . . . 0.0 110.277 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 562' ' ' ARG . . . . . 0.594 ' HB3' ' NE ' ' A' ' 546' ' ' ARG . 18.2 mmt180 -57.94 -70.97 0.12 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.87 -178.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -49.41 -33.75 14.68 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.983 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 564' ' ' ALA . . . . . 0.716 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -76.03 -23.82 55.16 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.6 ' O ' HD23 ' A' ' 569' ' ' LEU . 86.1 m-20 -79.56 -51.0 9.86 Favored 'General case' 0 CA--C 1.512 -0.49 0 C-N-CA 120.551 -0.459 . . . . 0.0 110.268 -178.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.629 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.4 OUTLIER -58.57 -43.86 89.56 Favored 'General case' 0 N--CA 1.424 -1.728 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.232 -178.702 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -66.13 -43.48 87.0 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.796 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 568' ' ' ALA . . . . . 0.533 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -56.99 -30.03 63.8 Favored 'General case' 0 C--N 1.312 -1.056 0 C-N-CA 118.901 -1.119 . . . . 0.0 108.031 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.6 HD23 ' O ' ' A' ' 565' ' ' ASN . 3.2 mm? -73.83 -46.0 47.8 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 75.5 mt -71.16 -43.43 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 CA-C-O 121.435 0.636 . . . . 0.0 109.348 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -57.51 -24.04 53.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.752 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . 0.484 HG22 ' NH2' ' A' ' 582' ' ' ARG . 35.1 p -100.66 -37.58 8.69 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 120.217 -0.593 . . . . 0.0 109.857 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 92.75 30.56 9.49 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.896 -0.593 . . . . 0.0 113.682 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 119.41 -29.85 5.99 Favored Glycine 0 C--O 1.228 -0.262 0 C-N-CA 120.361 -0.923 . . . . 0.0 112.624 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 575' ' ' ASP . . . . . 0.465 ' HB3' ' HB3' ' A' ' 578' ' ' ALA . 1.2 t0 -72.65 82.73 1.14 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 178.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.638 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -71.81 -34.92 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.705 0 CA-C-N 115.243 -0.89 . . . . 0.0 111.204 -176.874 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 577' ' ' ASN . . . . . 0.616 ' HA ' HG13 ' A' ' 580' ' ' ILE . 9.6 m-80 -64.79 -45.15 87.52 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 122.121 0.962 . . . . 0.0 108.544 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 578' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -63.14 -31.58 72.75 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 113.6 -1.637 . . . . 0.0 107.792 177.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -75.61 -30.39 59.54 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.472 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 580' ' ' ILE . . . . . 0.638 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.7 mt -66.46 -49.62 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-O 121.383 0.611 . . . . 0.0 110.703 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . 0.707 ' HA ' HD23 ' A' ' 584' ' ' LEU . 41.5 tt0 -67.64 -33.75 75.58 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.443 -179.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 582' ' ' ARG . . . . . 0.484 ' NH2' HG22 ' A' ' 572' ' ' THR . 0.5 OUTLIER -76.61 -36.1 57.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.583 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 583' ' ' LEU . . . . . 0.649 HD22 HD13 ' A' ' 554' ' ' LEU . 7.9 tp -68.9 -35.32 76.72 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.188 -178.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 584' ' ' LEU . . . . . 0.707 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.415 -2.211 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 546' ' ' ARG . . . . . 0.694 ' HB3' ' HB2' ' A' ' 551' ' ' LEU . 11.3 mmt180 . . . . . 0 N--CA 1.432 -1.336 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 547' ' ' PHE . . . . . 0.638 ' HB2' HD12 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 64.1 31.01 13.7 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 117.919 -1.513 . . . . 0.0 109.085 178.076 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 548' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 30.92 -84.48 0.0 OUTLIER 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.64 -1.164 . . . . 0.0 113.77 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 549' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 547' ' ' PHE . 15.2 mm100 -73.32 -50.68 20.78 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.761 -176.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 550' ' ' GLN . . . . . 0.62 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 6.8 mp0 -49.23 -35.01 16.22 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.109 178.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 551' ' ' LEU . . . . . 0.694 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -65.65 -47.0 77.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.898 177.413 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . 0.583 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 6.2 tp10 -53.4 -32.71 50.8 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.821 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 553' ' ' GLN . . . . . 0.653 ' HB3' HG21 ' A' ' 576' ' ' ILE . 46.8 mt-30 -71.72 -58.29 3.61 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.827 HD13 HD22 ' A' ' 583' ' ' LEU . 8.2 mt -60.38 -28.61 68.35 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 119.241 -0.984 . . . . 0.0 109.806 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . 0.419 ' OG ' HD12 ' A' ' 551' ' ' LEU . 8.0 m -70.09 -39.5 75.54 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.437 ' C ' ' H ' ' A' ' 558' ' ' GLY . . . -55.6 -26.31 43.23 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.831 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 557' ' ' MET . . . . . 0.619 ' HG3' HD13 ' A' ' 580' ' ' ILE . 88.9 mmm -81.53 31.34 0.35 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.578 0.704 . . . . 0.0 110.419 178.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . 0.437 ' H ' ' C ' ' A' ' 556' ' ' ALA . . . 64.96 33.33 86.96 Favored Glycine 0 CA--C 1.522 0.498 0 CA-C-N 114.578 -1.192 . . . . 0.0 113.752 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -111.55 141.71 44.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.951 0.375 . . . . 0.0 110.284 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.453 HD12 ' N ' ' A' ' 561' ' ' ASN . 3.8 pp -117.17 -34.69 4.28 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.446 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.453 ' N ' HD12 ' A' ' 560' ' ' LEU . 45.0 t-20 -51.36 95.36 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.054 0.454 . . . . 0.0 111.232 -179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 562' ' ' ARG . . . . . 0.58 ' HB3' ' HE ' ' A' ' 546' ' ' ARG . 14.6 mmt180 -55.78 -41.88 74.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.467 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -47.31 -51.29 19.69 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.886 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.5 -24.71 45.7 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.11 0.481 . . . . 0.0 111.016 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.782 ' O ' HD23 ' A' ' 569' ' ' LEU . 6.9 m-20 -59.89 -58.49 8.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.063 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.642 ' HB2' ' HA ' ' A' ' 546' ' ' ARG . 1.1 tp -67.13 -33.78 76.18 Favored 'General case' 0 N--CA 1.423 -1.798 0 O-C-N 122.291 -0.256 . . . . 0.0 110.837 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -70.56 -42.11 71.57 Favored 'General case' 0 CA--C 1.505 -0.782 0 C-N-CA 119.445 -0.902 . . . . 0.0 113.174 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 568' ' ' ALA . . . . . 0.586 ' HB3' ' CD1' ' A' ' 554' ' ' LEU . . . -64.92 -27.11 68.63 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.782 HD23 ' O ' ' A' ' 565' ' ' ASN . 2.9 mm? -71.24 -53.23 15.09 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.545 -178.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 69.3 mt -70.58 -36.43 65.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.059 0.457 . . . . 0.0 110.394 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -64.2 -23.99 67.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.46 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . 0.639 HG22 HH21 ' A' ' 582' ' ' ARG . 68.6 p -105.16 -40.63 5.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 119.764 -0.775 . . . . 0.0 110.512 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 98.11 43.48 2.8 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.526 -0.845 . . . . 0.0 113.59 176.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 574' ' ' GLY . . . . . 0.625 ' O ' HG12 ' A' ' 576' ' ' ILE . . . 107.7 -32.83 6.77 Favored Glycine 0 C--O 1.227 -0.282 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.452 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -65.16 90.6 0.09 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.659 ' O ' HG13 ' A' ' 580' ' ' ILE . 1.8 mm -70.56 -34.48 57.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.895 -177.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 577' ' ' ASN . . . . . 0.625 ' HA ' HG13 ' A' ' 580' ' ' ILE . 1.0 OUTLIER -67.29 -50.6 59.6 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.002 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -59.24 -30.59 68.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 113.99 -1.459 . . . . 0.0 107.644 177.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 579' ' ' ALA . . . . . 0.698 ' HB1' HD11 ' A' ' 554' ' ' LEU . . . -75.28 -30.54 60.46 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.122 -1.399 . . . . 0.0 111.533 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 580' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 576' ' ' ILE . 4.4 mt -65.97 -46.33 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-O 121.325 0.583 . . . . 0.0 110.574 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . 0.615 ' HA ' HD23 ' A' ' 584' ' ' LEU . 28.6 mm-40 -68.07 -36.56 80.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.815 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 582' ' ' ARG . . . . . 0.639 HH21 HG22 ' A' ' 572' ' ' THR . 1.9 ttp180 -76.43 -34.53 58.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.466 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 583' ' ' LEU . . . . . 0.827 HD22 HD13 ' A' ' 554' ' ' LEU . 6.8 tp -70.45 -33.01 70.81 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.87 -179.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 584' ' ' LEU . . . . . 0.615 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.415 -2.208 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 546' ' ' ARG . . . . . 0.817 ' NH1' HD22 ' A' ' 565' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.424 -1.728 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 547' ' ' PHE . . . . . 0.615 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.76 31.41 7.48 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 119.419 -0.912 . . . . 0.0 111.533 177.918 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 548' ' ' GLN . . . . . 0.468 ' HA ' HD23 ' A' ' 551' ' ' LEU . 6.8 mt-30 29.15 -82.31 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.499 1.12 . . . . 0.0 113.894 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 549' ' ' GLN . . . . . 0.476 ' N ' ' O ' ' A' ' 547' ' ' PHE . 29.6 mm-40 -72.58 -51.35 20.16 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.839 -177.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 550' ' ' GLN . . . . . 0.615 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 13.2 mp0 -50.88 -38.95 52.71 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.149 0.976 . . . . 0.0 108.538 178.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 551' ' ' LEU . . . . . 0.806 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -59.69 -45.56 91.73 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 114.089 -1.414 . . . . 0.0 109.707 175.487 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . 0.609 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 57.3 mt-10 -52.82 -32.73 45.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.117 -178.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 553' ' ' GLN . . . . . 0.479 ' NE2' ' HA ' ' A' ' 550' ' ' GLN . 0.5 OUTLIER -76.09 -59.21 2.86 Favored 'General case' 0 C--O 1.245 0.859 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -179.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.93 HD13 HD22 ' A' ' 583' ' ' LEU . 14.4 mt -63.28 -28.97 70.39 Favored 'General case' 0 C--N 1.346 0.449 0 C-N-CA 118.591 -1.244 . . . . 0.0 110.234 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . 0.697 ' HB2' HH22 ' A' ' 546' ' ' ARG . 47.2 t -70.38 -38.19 74.68 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 177.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' A' ' 552' ' ' GLU . . . -55.47 -26.38 42.04 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.795 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 557' ' ' MET . . . . . 0.485 ' HG3' HD13 ' A' ' 580' ' ' ILE . 0.0 OUTLIER -86.22 27.53 0.91 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.369 179.002 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 43.09 43.19 5.52 Favored Glycine 0 CA--C 1.523 0.535 0 CA-C-N 115.014 -0.994 . . . . 0.0 113.27 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 559' ' ' PHE . . . . . 0.466 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 1.9 m-85 -77.18 -40.48 45.15 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 27.7 mt 66.19 8.12 5.32 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 178.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 42.5 t-20 -110.97 82.5 1.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.626 0.25 . . . . 0.0 110.519 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 562' ' ' ARG . . . . . 0.534 ' HD3' HH12 ' A' ' 546' ' ' ARG . 19.6 mmt180 -57.05 -31.96 65.72 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.164 0.506 . . . . 0.0 111.443 -178.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.33 -52.67 60.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.56 -179.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -79.52 -25.38 41.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.423 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.817 HD22 ' NH1' ' A' ' 546' ' ' ARG . 81.1 m-20 -60.23 -59.5 5.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.988 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.486 ' HB2' ' CD ' ' A' ' 546' ' ' ARG . 0.3 OUTLIER -66.12 -30.65 71.18 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.502 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -71.12 -33.06 69.77 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 119.23 -0.988 . . . . 0.0 111.642 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 568' ' ' ALA . . . . . 0.525 ' HB3' ' CD1' ' A' ' 554' ' ' LEU . . . -71.51 -28.47 63.92 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 177.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.687 HD23 ' O ' ' A' ' 565' ' ' ASN . 3.3 mm? -72.13 -53.52 12.48 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.975 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 90.0 mt -66.51 -38.51 81.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.552 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -70.42 -17.48 63.01 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.6 p -105.4 -40.87 5.67 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.026 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 92.84 42.1 4.51 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.886 176.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 113.14 -34.94 4.82 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.413 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.17 87.82 0.8 Allowed 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.6 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -77.25 -26.84 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.17 -176.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 577' ' ' ASN . . . . . 0.693 ' HA ' HG13 ' A' ' 580' ' ' ILE . 14.7 m-80 -68.53 -53.7 21.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -58.77 -29.65 66.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.053 -1.43 . . . . 0.0 107.632 177.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 579' ' ' ALA . . . . . 0.487 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -75.06 -27.64 60.06 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 114.121 -1.4 . . . . 0.0 110.934 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 580' ' ' ILE . . . . . 0.693 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.5 mt -68.74 -45.26 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.193 0.52 . . . . 0.0 110.398 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . 0.793 ' HA ' HD23 ' A' ' 584' ' ' LEU . 36.1 tt0 -68.32 -37.52 80.66 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.814 -178.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 582' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 582' ' ' ARG . 0.0 OUTLIER -76.26 -31.75 58.46 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.965 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 583' ' ' LEU . . . . . 0.93 HD22 HD13 ' A' ' 554' ' ' LEU . 7.5 tp -71.23 -25.67 62.59 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-O 121.306 0.574 . . . . 0.0 109.705 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 584' ' ' LEU . . . . . 0.793 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.415 -2.182 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.597 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 546' ' ' ARG . . . . . 0.827 HH11 ' HG3' ' A' ' 546' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.422 -1.857 0 N-CA-C 113.024 0.749 . . . . 0.0 113.024 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 547' ' ' PHE . . . . . 0.576 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 65.92 29.94 10.07 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.134 178.196 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 548' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 30.4 -83.32 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 124.672 1.189 . . . . 0.0 113.953 179.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 549' ' ' GLN . . . . . 0.45 ' N ' ' O ' ' A' ' 547' ' ' PHE . 21.6 mt-30 -72.19 -50.99 23.25 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.221 -177.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 550' ' ' GLN . . . . . 0.784 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 0.9 OUTLIER -50.87 -33.05 22.3 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 122.579 1.181 . . . . 0.0 108.501 177.819 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 551' ' ' LEU . . . . . 0.802 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -65.3 -45.08 85.78 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.767 175.488 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . 0.57 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 24.4 mm-40 -53.81 -37.76 63.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.136 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 553' ' ' GLN . . . . . 0.793 HE21 HD11 ' A' ' 569' ' ' LEU . 3.5 pp0? -72.88 -56.71 4.8 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 120.336 -0.546 . . . . 0.0 112.047 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.782 ' HG ' HE22 ' A' ' 553' ' ' GLN . 11.5 mt -58.69 -29.71 66.84 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 118.359 -1.336 . . . . 0.0 110.087 178.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 47.2 t -68.95 -40.05 79.18 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -56.66 -27.38 58.49 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.982 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 95.6 mmm -89.94 21.97 3.39 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.708 0.766 . . . . 0.0 109.102 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 47.84 36.79 14.22 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 114.205 -1.361 . . . . 0.0 113.363 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 559' ' ' PHE . . . . . 0.516 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 0.3 OUTLIER -61.65 -42.99 99.67 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.546 -0.461 . . . . 0.0 111.672 179.351 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 63.2 mt 63.22 1.94 1.02 Allowed 'General case' 0 C--O 1.232 0.146 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -108.04 85.55 2.14 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 562' ' ' ARG . . . . . 0.41 ' HG2' ' H ' ' A' ' 562' ' ' ARG . 24.7 mmt180 -56.05 -50.76 70.06 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.78 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -47.4 -51.36 20.12 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.271 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.94 -25.22 43.62 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.279 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.789 HD22 ' NH1' ' A' ' 546' ' ' ARG . 89.3 m-20 -60.44 -59.74 4.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.565 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.631 HD13 ' HA ' ' A' ' 546' ' ' ARG . 2.1 tp -62.04 -29.49 70.32 Favored 'General case' 0 N--CA 1.421 -1.875 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 567' ' ' GLN . . . . . 0.517 HE21 ' HA ' ' A' ' 567' ' ' GLN . 0.1 OUTLIER -68.1 -33.98 75.54 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.171 179.099 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 568' ' ' ALA . . . . . 0.568 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -75.94 -43.34 45.38 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.809 0.338 . . . . 0.0 110.913 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.793 HD11 HE21 ' A' ' 553' ' ' GLN . 3.9 mm? -58.99 -48.56 81.15 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.021 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 84.1 mt -71.78 -40.67 69.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.244 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 571' ' ' ALA . . . . . 0.464 ' HB2' ' O ' ' A' ' 567' ' ' GLN . . . -58.76 -19.45 40.64 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 25.3 p -114.57 -39.92 3.69 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.659 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 89.32 46.44 4.38 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.059 177.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 574' ' ' GLY . . . . . 0.58 ' O ' HG12 ' A' ' 576' ' ' ILE . . . 109.57 -26.97 13.06 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.337 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.55 86.7 0.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.627 ' O ' HG13 ' A' ' 580' ' ' ILE . 7.2 mm -68.1 -44.77 84.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.204 -176.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 577' ' ' ASN . . . . . 0.549 ' HA ' HG13 ' A' ' 580' ' ' ILE . 10.9 m-80 -67.28 -53.58 28.52 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.391 -177.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -57.85 -31.0 66.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.686 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 579' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 583' ' ' LEU . . . -75.31 -29.32 60.0 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.339 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 580' ' ' ILE . . . . . 0.627 HG13 ' O ' ' A' ' 576' ' ' ILE . 1.9 mt -69.4 -47.12 74.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-O 120.971 0.415 . . . . 0.0 111.355 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . 0.649 ' HA ' HD23 ' A' ' 584' ' ' LEU . 40.8 tt0 -69.69 -38.48 77.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.528 -178.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 582' ' ' ARG . . . . . 0.628 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -75.23 -32.15 61.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.583 -179.092 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 583' ' ' LEU . . . . . 0.628 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 8.9 tp -71.69 -32.0 67.36 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.721 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 584' ' ' LEU . . . . . 0.649 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.409 -2.479 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 546' ' ' ARG . . . . . 0.679 ' CZ ' ' HB2' ' A' ' 565' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.41 0 N-CA-C 111.736 0.273 . . . . 0.0 111.736 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 547' ' ' PHE . . . . . 0.57 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.9 15.52 10.16 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 119.302 -0.959 . . . . 0.0 109.432 -179.183 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 548' ' ' GLN . . . . . 0.556 ' HA ' HD23 ' A' ' 551' ' ' LEU . 1.5 mt-30 34.69 -79.6 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.777 177.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 549' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 547' ' ' PHE . 95.5 mt-30 -72.07 -51.9 19.41 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.071 -177.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 550' ' ' GLN . . . . . 0.638 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 2.5 mp0 -52.45 -40.49 62.33 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 115.526 -0.761 . . . . 0.0 108.991 177.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 551' ' ' LEU . . . . . 0.679 ' HA ' HH22 ' A' ' 546' ' ' ARG . 0.1 OUTLIER -60.01 -45.55 92.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.138 176.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . 0.611 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 10.1 mm-40 -53.73 -31.8 49.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.605 -179.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 553' ' ' GLN . . . . . 0.608 ' HB3' HG21 ' A' ' 576' ' ' ILE . 7.0 mt-30 -75.78 -59.02 2.94 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.577 HD22 ' CZ ' ' A' ' 559' ' ' PHE . 10.9 mt -60.68 -30.37 69.88 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 119.681 1.128 . . . . 0.0 110.041 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . 0.482 ' OG ' HD12 ' A' ' 551' ' ' LEU . 46.7 m -70.26 -42.05 72.66 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -56.48 -22.03 29.72 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.935 178.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 87.9 mmm -95.53 22.09 7.46 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.181 0.515 . . . . 0.0 110.408 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 55.43 46.33 80.89 Favored Glycine 0 CA--C 1.52 0.372 0 CA-C-N 115.492 -0.776 . . . . 0.0 113.318 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 559' ' ' PHE . . . . . 0.651 ' CE2' ' HG ' ' A' ' 583' ' ' LEU . 0.6 OUTLIER -65.7 -42.69 90.88 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.722 0.261 . . . . 0.0 111.473 179.475 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 57.2 mt 75.42 11.35 3.37 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 176.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.432 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 41.3 t-20 -146.14 95.87 2.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.834 0.35 . . . . 0.0 110.288 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 562' ' ' ARG . . . . . 0.575 ' HA ' ' ND2' ' A' ' 565' ' ' ASN . 22.9 mmt180 -57.14 -58.52 7.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.89 -178.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -53.63 -33.31 54.68 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.816 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 564' ' ' ALA . . . . . 0.432 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -75.71 -24.41 56.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.374 -178.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.679 ' HB2' ' CZ ' ' A' ' 546' ' ' ARG . 16.8 m-20 -70.84 -50.91 30.26 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.643 ' HB2' ' NE ' ' A' ' 546' ' ' ARG . 1.0 OUTLIER -51.73 -48.1 63.76 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -54.42 -46.23 73.16 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.735 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 568' ' ' ALA . . . . . 0.542 ' HB1' ' HB1' ' A' ' 579' ' ' ALA . . . -67.34 -41.66 84.84 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 111.619 0.229 . . . . 0.0 111.619 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.743 HD11 HD11 ' A' ' 576' ' ' ILE . 3.5 mm? -63.44 -42.56 98.67 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 120.843 0.354 . . . . 0.0 111.921 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 30.7 mm -64.44 -35.13 73.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.173 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -87.53 -17.12 32.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.105 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . 0.608 ' HB ' ' HB3' ' A' ' 575' ' ' ASP . 76.4 p -106.43 0.82 25.11 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 53.7 30.73 44.14 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.931 -0.652 . . . . 0.0 113.773 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 102.52 -2.16 49.69 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.891 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 575' ' ' ASP . . . . . 0.608 ' HB3' ' HB ' ' A' ' 572' ' ' THR . 2.6 t0 -77.75 77.73 4.26 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.743 HD11 HD11 ' A' ' 569' ' ' LEU . 10.4 mm -58.18 -35.08 51.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.941 -177.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 577' ' ' ASN . . . . . 0.633 ' HA ' HG13 ' A' ' 580' ' ' ILE . 5.9 m-80 -67.76 -45.14 75.77 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.036 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 578' ' ' ALA . . . . . 0.51 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -61.88 -34.49 76.11 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.502 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 579' ' ' ALA . . . . . 0.542 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -71.83 -30.98 66.06 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.893 -1.048 . . . . 0.0 110.915 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 580' ' ' ILE . . . . . 0.633 HG13 ' HA ' ' A' ' 577' ' ' ASN . 3.5 mt -61.1 -56.82 15.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.616 0 CA-C-O 121.364 0.602 . . . . 0.0 110.839 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -65.36 -29.66 70.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.116 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 582' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 578' ' ' ALA . 1.1 ttt180 -77.13 -47.64 19.87 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 583' ' ' LEU . . . . . 0.651 ' HG ' ' CE2' ' A' ' 559' ' ' PHE . 3.3 tm? -53.49 -58.04 8.56 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-O 121.212 0.529 . . . . 0.0 110.938 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 584' ' ' LEU . . . . . . . . . . . . . 3.5 mt . . . . . 0 N--CA 1.394 -3.245 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.178 -179.749 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 546' ' ' ARG . . . . . 0.73 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 10.4 mmt180 . . . . . 0 C--O 1.223 -0.298 0 CA-C-O 120.616 0.246 . . . . 0.0 111.461 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 547' ' ' PHE . . . . . 0.673 ' HB2' ' HG ' ' A' ' 566' ' ' LEU . 0.1 OUTLIER 32.4 37.85 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 176.712 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 548' ' ' GLN . . . . . 0.69 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 4.7 pt20 23.87 -84.12 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.299 1.04 . . . . 0.0 113.631 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 549' ' ' GLN . . . . . 0.69 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 4.5 pt20 -73.76 -50.33 21.16 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.635 -177.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 550' ' ' GLN . . . . . 0.771 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 1.3 mm100 -50.09 -44.09 51.76 Favored 'General case' 0 C--O 1.25 1.082 0 CA-C-O 121.654 0.74 . . . . 0.0 111.541 -178.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 551' ' ' LEU . . . . . 0.768 HD13 HD22 ' A' ' 565' ' ' ASN . 0.1 OUTLIER -72.64 -34.27 67.18 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.6 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -52.17 -32.24 35.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 553' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 549' ' ' GLN . 1.7 mp0 -74.39 -58.53 3.23 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.02 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.941 HD13 HD22 ' A' ' 583' ' ' LEU . 12.5 mt -60.38 -29.29 68.84 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 118.59 -1.244 . . . . 0.0 110.775 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . 0.436 ' HB2' ' CD1' ' A' ' 551' ' ' LEU . 25.3 t -70.18 -37.4 75.13 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 553' ' ' GLN . . . -55.14 -27.98 49.38 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.794 178.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 557' ' ' MET . . . . . 0.466 ' O ' ' SD ' ' A' ' 557' ' ' MET . 0.0 OUTLIER -81.73 19.51 1.06 Allowed 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 122.586 1.184 . . . . 0.0 109.111 178.642 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 558' ' ' GLY . . . . . 0.424 ' H ' ' C ' ' A' ' 556' ' ' ALA . . . 52.81 48.97 56.08 Favored Glycine 0 CA--C 1.524 0.61 0 CA-C-N 114.723 -1.126 . . . . 0.0 113.57 -178.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 559' ' ' PHE . . . . . 0.569 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 0.8 OUTLIER -74.86 -36.82 62.32 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 179.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 560' ' ' LEU . . . . . 0.544 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 56.5 mt 74.0 3.54 4.44 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 178.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -125.6 95.54 4.48 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 562' ' ' ARG . . . . . 0.509 ' HB2' ' HE ' ' A' ' 546' ' ' ARG . 8.2 mmm180 -60.2 -63.15 1.4 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.374 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -50.17 -38.58 40.33 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.143 0.497 . . . . 0.0 111.934 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -68.73 -24.96 64.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.779 -178.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.768 HD22 HD13 ' A' ' 551' ' ' LEU . 29.6 m-20 -80.26 -51.17 9.24 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 566' ' ' LEU . . . . . 0.721 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.5 OUTLIER -51.5 -36.45 44.68 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -177.925 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -68.57 -42.84 77.73 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.564 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 568' ' ' ALA . . . . . 0.524 ' HB1' ' HB1' ' A' ' 579' ' ' ALA . . . -61.53 -28.35 69.26 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.763 176.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.771 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 4.3 mm? -72.54 -52.08 17.18 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.47 -178.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 89.1 mt -67.8 -39.5 82.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.175 0.512 . . . . 0.0 109.779 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -63.19 -19.64 64.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.564 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 572' ' ' THR . . . . . 0.413 HG21 ' HB2' ' A' ' 579' ' ' ALA . 34.6 p -108.23 -39.57 5.43 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 119.739 -0.785 . . . . 0.0 110.31 179.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 91.07 39.77 5.67 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.859 -0.686 . . . . 0.0 113.179 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 114.93 -30.18 6.99 Favored Glycine 0 C--N 1.333 0.391 0 C-N-CA 120.32 -0.943 . . . . 0.0 112.676 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -75.89 85.94 2.84 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 576' ' ' ILE . . . . . 0.602 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -73.99 -28.14 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.664 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.931 -177.244 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 577' ' ' ASN . . . . . 0.661 ' HA ' HG13 ' A' ' 580' ' ' ILE . 14.7 m-80 -68.73 -53.28 22.95 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 124.257 0.973 . . . . 0.0 108.722 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -60.08 -30.04 68.97 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.258 -1.337 . . . . 0.0 107.756 177.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 579' ' ' ALA . . . . . 0.524 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -74.25 -28.89 61.44 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.777 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 580' ' ' ILE . . . . . 0.661 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.2 mt -67.01 -42.38 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-O 121.302 0.572 . . . . 0.0 110.286 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 581' ' ' GLU . . . . . 0.637 ' HA ' HD23 ' A' ' 584' ' ' LEU . 37.7 tt0 -69.89 -40.49 75.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.826 -178.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 582' ' ' ARG . . . . . 0.632 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -76.32 -35.14 58.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.148 -178.554 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 583' ' ' LEU . . . . . 0.941 HD22 HD13 ' A' ' 554' ' ' LEU . 13.4 tp -71.45 -32.24 68.1 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-O 121.072 0.463 . . . . 0.0 110.371 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 584' ' ' LEU . . . . . 0.637 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.41 -2.43 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.163 0 N-CA-C 112.479 -0.248 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 76.0 p -158.24 72.34 3.96 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.674 0.273 . . . . 0.0 111.015 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -79.97 -178.29 4.42 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.551 2.168 . . . . 0.0 111.959 179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -103.83 117.72 35.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.003 0.43 . . . . 0.0 110.544 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' PHE . . . . . 0.505 ' O ' HD11 ' A' ' 566' ' ' LEU . 87.9 m-85 -58.4 -12.32 3.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.573 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -61.53 -53.13 60.44 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.686 0.279 . . . . 0.0 111.644 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . 0.49 ' HB3' ' HG2' ' A' ' 544' ' ' GLU . 90.8 m-20 -52.95 137.1 46.56 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.22 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . 0.471 ' HB2' ' HG3' ' A' ' 563' ' ' GLU . 92.7 Cg_endo -78.73 5.22 5.78 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.524 2.149 . . . . 0.0 112.358 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 544' ' ' GLU . . . . . 0.49 ' HG2' ' HB3' ' A' ' 542' ' ' ASN . 10.4 pt-20 -73.48 -54.22 8.76 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 545' ' ' VAL . . . . . 0.437 ' N ' ' HG3' ' A' ' 544' ' ' GLU . 97.0 t -61.51 -40.33 86.07 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.684 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 178.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 546' ' ' ARG . . . . . 0.687 ' HA ' ' HB2' ' A' ' 566' ' ' LEU . 5.8 mtm180 65.07 30.28 11.72 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.227 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 547' ' ' PHE . . . . . 0.676 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 63.99 18.23 11.08 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 -177.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 548' ' ' GLN . . . . . 0.472 ' HA ' HD23 ' A' ' 551' ' ' LEU . 1.8 mt-30 29.89 -78.7 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 113.773 -1.558 . . . . 0.0 114.133 177.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 549' ' ' GLN . . . . . 0.558 ' O ' ' HB3' ' A' ' 552' ' ' GLU . 15.0 mm100 -71.4 -50.82 28.15 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.425 -177.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 550' ' ' GLN . . . . . 0.796 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 4.1 mm100 -52.09 -40.67 61.58 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-N 115.088 -0.96 . . . . 0.0 108.874 178.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 551' ' ' LEU . . . . . 0.548 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -62.63 -40.74 97.96 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 114.804 -1.089 . . . . 0.0 109.724 177.706 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . 0.558 ' HB3' ' O ' ' A' ' 549' ' ' GLN . 5.1 tp10 -53.59 -32.12 49.73 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.55 -179.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.476 ' NE2' ' HA ' ' A' ' 550' ' ' GLN . 0.4 OUTLIER -77.39 -58.46 3.26 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-O 118.826 -0.607 . . . . 0.0 112.614 179.611 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.655 HD13 HD22 ' A' ' 583' ' ' LEU . 10.9 mt -57.85 -32.43 67.63 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 120.43 1.468 . . . . 0.0 110.369 178.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . 0.427 ' HB2' HD12 ' A' ' 551' ' ' LEU . 44.9 t -68.9 -40.16 79.3 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -55.35 -27.17 45.51 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.503 179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 557' ' ' MET . . . . . 0.715 ' HG3' HD13 ' A' ' 580' ' ' ILE . 26.5 mmm -89.31 24.98 2.03 Favored 'General case' 0 C--O 1.232 0.137 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.898 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 75.56 39.94 33.68 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 115.416 0.926 . . . . 0.0 115.416 178.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 559' ' ' PHE . . . . . 0.498 ' HB2' ' O ' ' A' ' 554' ' ' LEU . 10.3 m-85 -104.44 126.89 51.95 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 118.189 0.995 . . . . 0.0 110.662 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 87.9 mt -96.31 -18.85 19.69 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -77.18 82.2 3.67 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 562' ' ' ARG . . . . . 0.604 ' HA ' ' ND2' ' A' ' 565' ' ' ASN . 15.6 mmt180 -59.89 -53.54 56.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.791 -177.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . 0.471 ' HG3' ' HB2' ' A' ' 543' ' ' PRO . 1.8 mp0 -52.33 -31.85 35.2 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.457 0.646 . . . . 0.0 110.794 178.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -73.47 -23.24 60.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.012 -178.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.793 ' O ' HD23 ' A' ' 569' ' ' LEU . 14.8 m-20 -78.65 -47.8 16.32 Favored 'General case' 0 CA--C 1.515 -0.372 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -179.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.687 ' HB2' ' HA ' ' A' ' 546' ' ' ARG . 0.6 OUTLIER -52.48 -47.92 66.23 Favored 'General case' 0 N--CA 1.42 -1.926 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 -179.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -72.34 -38.12 68.69 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.981 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 568' ' ' ALA . . . . . 0.412 ' HB3' ' CD1' ' A' ' 554' ' ' LEU . . . -60.39 -31.89 70.79 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 118.93 -1.108 . . . . 0.0 108.424 178.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.796 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 4.0 mm? -73.84 -37.43 64.82 Favored 'General case' 0 N--CA 1.428 -1.561 0 CA-C-O 120.893 0.377 . . . . 0.0 111.818 -178.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 22.7 mm -65.43 -38.6 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.778 -179.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -81.13 -15.53 55.61 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.394 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . 0.592 HG21 ' HB2' ' A' ' 579' ' ' ALA . 39.6 p -104.86 4.59 32.23 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 47.4 32.01 7.05 Favored Glycine 0 C--N 1.337 0.585 0 N-CA-C 115.027 0.771 . . . . 0.0 115.027 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 574' ' ' GLY . . . . . 0.436 ' HA2' ' NE2' ' A' ' 550' ' ' GLN . . . 108.1 -17.46 34.85 Favored Glycine 0 C--O 1.229 -0.178 0 C-N-CA 120.078 -1.058 . . . . 0.0 113.212 179.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 575' ' ' ASP . . . . . 0.479 ' HB3' ' HB3' ' A' ' 578' ' ' ALA . 3.3 m-20 -75.27 78.82 2.37 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.029 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.684 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -67.54 -33.86 64.77 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.834 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.976 -177.079 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 577' ' ' ASN . . . . . 0.57 ' HA ' HG13 ' A' ' 580' ' ' ILE . 1.0 OUTLIER -66.29 -46.68 76.15 Favored 'General case' 0 N--CA 1.446 -0.675 0 O-C-N 124.334 1.021 . . . . 0.0 108.697 179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 578' ' ' ALA . . . . . 0.479 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -62.55 -31.04 71.76 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.981 -1.463 . . . . 0.0 107.742 177.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . 0.592 ' HB2' HG21 ' A' ' 572' ' ' THR . . . -74.26 -33.9 63.44 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 114.364 -1.289 . . . . 0.0 111.271 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 580' ' ' ILE . . . . . 0.715 HD13 ' HG3' ' A' ' 557' ' ' MET . 3.7 mt -62.78 -44.02 99.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 121.444 0.64 . . . . 0.0 110.431 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . 0.444 ' HA ' HD23 ' A' ' 584' ' ' LEU . 39.7 mt-10 -68.94 -39.17 79.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.711 -178.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 582' ' ' ARG . . . . . . . . . . . . . 2.2 ttt85 -77.44 -40.8 42.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.406 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 583' ' ' LEU . . . . . 0.655 HD22 HD13 ' A' ' 554' ' ' LEU . 8.2 tp -62.52 -44.58 96.01 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.624 -177.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 584' ' ' LEU . . . . . 0.504 ' O ' HD12 ' A' ' 584' ' ' LEU . 0.2 OUTLIER -69.14 -18.96 64.01 Favored 'General case' 0 N--CA 1.42 -1.972 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -58.37 -73.75 0.43 Allowed Glycine 0 C--N 1.335 0.507 0 CA-C-N 114.806 -1.088 . . . . 0.0 111.811 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 54.2 m -147.62 -61.54 0.27 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.892 0.377 . . . . 0.0 110.513 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.259 -0.877 . . . . 0.0 110.945 179.948 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' SER . . . . . 0.557 ' HB3' ' HD3' ' A' ' 538' ' ' PRO . 42.4 t -92.94 -49.67 0.28 Allowed Pre-proline 0 CA--C 1.534 0.328 0 N-CA-C 111.539 0.199 . . . . 0.0 111.539 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' PRO . . . . . 0.557 ' HD3' ' HB3' ' A' ' 537' ' ' SER . 8.8 Cg_exo -72.09 -147.86 0.03 OUTLIER 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.413 2.076 . . . . 0.0 112.378 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 62.92 -99.51 0.08 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.213 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 52.1 p90 -61.96 -6.14 2.63 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 26.6 tt0 -74.62 -59.92 2.51 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.424 -0.51 . . . . 0.0 109.671 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -131.48 149.91 74.88 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.332 177.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -84.46 17.73 1.68 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.654 2.236 . . . . 0.0 111.492 179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 544' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -74.16 -55.51 5.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.821 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 545' ' ' VAL . . . . . 0.507 ' O ' ' HB2' ' A' ' 546' ' ' ARG . 47.6 t -65.74 -38.93 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.626 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 546' ' ' ARG . . . . . 0.601 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 6.3 mtm180 70.37 36.07 1.86 Allowed 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.284 178.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 547' ' ' PHE . . . . . 0.564 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 59.34 22.6 10.99 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 -178.13 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 548' ' ' GLN . . . . . 0.728 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.9 pt20 29.42 -79.16 0.0 OUTLIER 'General case' 0 C--N 1.342 0.257 0 C-N-CA 125.516 1.527 . . . . 0.0 114.325 178.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 549' ' ' GLN . . . . . 0.728 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 24.6 mt-30 -71.7 -49.84 35.79 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.752 0.787 . . . . 0.0 111.006 -177.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 550' ' ' GLN . . . . . 0.633 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 11.2 mp0 -52.28 -40.33 61.63 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.345 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 551' ' ' LEU . . . . . 0.601 ' HB3' ' O ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -60.22 -40.23 89.43 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.749 176.684 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . 0.523 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 42.1 mt-10 -53.33 -32.35 48.62 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.752 -179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.454 ' CD ' HD12 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -78.29 -59.02 2.95 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 118.925 -0.56 . . . . 0.0 112.057 179.667 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.586 HD12 HD23 ' A' ' 569' ' ' LEU . 8.1 mt -54.28 -33.02 57.75 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 120.092 1.315 . . . . 0.0 110.992 177.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . 0.418 ' HB2' HD12 ' A' ' 551' ' ' LEU . 48.4 t -69.91 -39.8 75.99 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.35 -33.46 59.09 Favored 'General case' 0 N--CA 1.455 -0.202 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 43.1 mmm -97.58 22.09 9.42 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 119.177 0.898 . . . . 0.0 111.077 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . 0.413 ' O ' ' O ' ' A' ' 559' ' ' PHE . . . 117.14 -118.85 4.26 Favored Glycine 0 N--CA 1.451 -0.328 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 -179.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 559' ' ' PHE . . . . . 0.449 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 90.4 m-85 29.85 112.01 0.0 OUTLIER 'General case' 0 C--O 1.232 0.139 0 N-CA-C 116.018 1.859 . . . . 0.0 116.018 178.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 68.3 mt -107.83 8.92 28.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.533 178.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.578 ' HB2' ' HB3' ' A' ' 564' ' ' ALA . 0.3 OUTLIER -87.9 105.75 17.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 CA-C-N 114.681 -1.145 . . . . 0.0 110.136 179.875 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 562' ' ' ARG . . . . . 0.569 ' HD2' ' HD3' ' A' ' 546' ' ' ARG . 24.2 mmt180 -59.6 -68.75 0.25 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.457 -0.792 . . . . 0.0 112.555 -178.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.89 -32.11 31.15 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.217 -179.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 564' ' ' ALA . . . . . 0.578 ' HB3' ' HB2' ' A' ' 561' ' ' ASN . . . -76.76 -24.72 52.96 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -177.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.599 ' O ' HD23 ' A' ' 569' ' ' LEU . 86.1 m-20 -78.68 -49.84 12.45 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 120.816 0.341 . . . . 0.0 110.61 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.541 HD12 ' N ' ' A' ' 547' ' ' PHE . 1.1 tp -57.31 -45.77 83.88 Favored 'General case' 0 N--CA 1.421 -1.883 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.139 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -71.94 -40.22 68.88 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 113.597 0.962 . . . . 0.0 113.597 -178.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 568' ' ' ALA . . . . . 0.582 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -57.29 -30.32 64.61 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.21 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.633 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.3 mm? -72.68 -34.93 67.54 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.496 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 570' ' ' ILE . . . . . 0.425 HD13 ' HE2' ' A' ' 547' ' ' PHE . 39.1 mm -73.86 -42.1 53.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-O 121.474 0.654 . . . . 0.0 109.246 179.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -57.62 -29.21 64.34 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.726 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 32.0 p -99.37 -38.73 8.72 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.766 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 93.88 27.47 12.53 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.891 -0.671 . . . . 0.0 113.227 177.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 126.28 -33.04 3.58 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.49 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.8 79.64 1.13 Allowed 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 178.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.637 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -64.83 -36.09 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.927 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.12 -176.819 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 577' ' ' ASN . . . . . 0.587 ' HA ' HG13 ' A' ' 580' ' ' ILE . 1.0 OUTLIER -65.22 -40.2 93.8 Favored 'General case' 0 N--CA 1.442 -0.834 0 O-C-N 124.324 1.015 . . . . 0.0 108.501 179.223 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -66.59 -33.26 75.28 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 113.968 -1.469 . . . . 0.0 108.027 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . 0.526 ' HA ' ' HG2' ' A' ' 582' ' ' ARG . . . -73.51 -33.64 64.87 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.855 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 580' ' ' ILE . . . . . 0.637 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.8 mt -61.62 -48.67 87.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 121.494 0.664 . . . . 0.0 110.599 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . 0.567 ' HA ' HD23 ' A' ' 584' ' ' LEU . 37.4 tt0 -67.67 -36.83 81.44 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.797 -1.092 . . . . 0.0 111.895 -178.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 582' ' ' ARG . . . . . 0.64 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -77.87 -38.98 44.71 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.183 0.516 . . . . 0.0 110.647 -179.199 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 583' ' ' LEU . . . . . 0.64 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 11.2 tp -63.91 -40.41 96.43 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 123.674 0.79 . . . . 0.0 110.878 -178.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 584' ' ' LEU . . . . . 0.567 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER -79.77 -17.16 54.1 Favored 'General case' 0 N--CA 1.419 -2.021 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 178.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -76.36 7.87 28.84 Favored Glycine 0 C--N 1.334 0.454 0 CA-C-N 115.02 -0.991 . . . . 0.0 112.757 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 77.9 p -143.48 52.7 1.34 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 0.0 110.87 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.249 -0.881 . . . . 0.0 111.062 -179.819 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.185 0 N-CA-C 112.523 -0.231 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' SER . . . . . 0.667 ' H ' ' HD2' ' A' ' 538' ' ' PRO . 66.1 m -157.37 -53.5 0.02 OUTLIER Pre-proline 0 CA--C 1.534 0.338 0 N-CA-C 111.498 0.185 . . . . 0.0 111.498 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' PRO . . . . . 0.667 ' HD2' ' H ' ' A' ' 537' ' ' SER . 73.2 Cg_endo -75.11 87.45 1.33 Allowed 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.041 1.827 . . . . 0.0 112.317 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -131.14 -46.01 1.01 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.653 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -69.64 -30.59 68.34 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.677 0.275 . . . . 0.0 111.13 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . 0.409 ' HG3' ' N ' ' A' ' 542' ' ' ASN . 4.1 pt20 -59.28 -48.58 81.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.236 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . 0.409 ' N ' ' HG3' ' A' ' 541' ' ' GLN . 81.7 m-20 -62.89 137.99 97.03 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.109 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -80.89 10.07 3.52 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.607 2.205 . . . . 0.0 112.859 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 544' ' ' GLU . . . . . 0.481 ' HG3' ' H ' ' A' ' 545' ' ' VAL . 7.8 pt-20 -72.54 -55.61 6.67 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 545' ' ' VAL . . . . . 0.577 HG12 ' H ' ' A' ' 548' ' ' GLN . 55.5 t -67.94 -39.18 81.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 546' ' ' ARG . . . . . 0.801 ' NH1' HD22 ' A' ' 565' ' ' ASN . 0.0 OUTLIER 72.58 38.01 0.83 Allowed 'General case' 0 N--CA 1.421 -1.921 0 CA-C-N 114.247 -1.342 . . . . 0.0 112.361 179.097 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 547' ' ' PHE . . . . . 0.583 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.08 28.69 10.25 Favored 'General case' 0 N--CA 1.442 -0.83 0 C-N-CA 119.322 -0.951 . . . . 0.0 109.713 178.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 548' ' ' GLN . . . . . 0.717 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 6.5 pt20 28.16 -81.6 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 125.004 1.322 . . . . 0.0 114.228 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 549' ' ' GLN . . . . . 0.717 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 3.7 pt20 -73.34 -50.07 23.95 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.334 -178.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 550' ' ' GLN . . . . . 0.702 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 11.9 mp0 -50.11 -36.26 29.01 Favored 'General case' 0 C--O 1.245 0.843 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 177.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 551' ' ' LEU . . . . . 0.749 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -62.68 -45.15 94.13 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 114.137 -1.392 . . . . 0.0 109.928 177.0 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . 0.59 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 14.6 mm-40 -52.87 -32.09 42.97 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.362 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.629 ' HG3' HD12 ' A' ' 576' ' ' ILE . 8.5 mm-40 -73.61 -60.24 2.34 Favored 'General case' 0 C--O 1.246 0.894 0 N-CA-C 112.424 0.528 . . . . 0.0 112.424 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.938 HD13 HD22 ' A' ' 583' ' ' LEU . 11.6 mt -62.91 -29.86 71.1 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.535 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . 0.566 ' HB2' HD12 ' A' ' 551' ' ' LEU . 46.7 t -69.73 -38.47 76.86 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 177.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -55.91 -26.58 48.21 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.434 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 557' ' ' MET . . . . . 0.618 ' HG3' HD13 ' A' ' 580' ' ' ILE . 84.8 mmm -87.34 25.32 1.42 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 121.317 0.58 . . . . 0.0 110.138 178.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 44.31 44.15 7.73 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-N 114.728 -1.124 . . . . 0.0 113.633 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 559' ' ' PHE . . . . . 0.486 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 1.6 m-85 -76.11 -41.96 48.6 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 113.353 0.872 . . . . 0.0 113.353 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 23.4 mt 66.28 7.15 4.68 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 178.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.428 ' C ' HD22 ' A' ' 561' ' ' ASN . 0.2 OUTLIER -108.98 79.56 1.23 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 179.398 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 562' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 562' ' ' ARG . 7.1 mmt180 -58.65 -29.07 66.26 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.59 -178.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -65.16 -51.84 58.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.075 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 564' ' ' ALA . . . . . 0.41 ' H ' ' ND2' ' A' ' 561' ' ' ASN . . . -78.81 -25.1 44.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.253 -178.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.801 HD22 ' NH1' ' A' ' 546' ' ' ARG . 90.0 m-20 -60.8 -58.02 10.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.781 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.648 HD13 ' HA ' ' A' ' 546' ' ' ARG . 2.1 tp -63.82 -30.95 71.99 Favored 'General case' 0 N--CA 1.424 -1.751 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 7.6 tp-100 -69.9 -32.01 70.1 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.385 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 568' ' ' ALA . . . . . 0.651 ' HB1' ' HB1' ' A' ' 579' ' ' ALA . . . -77.36 -38.91 49.14 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.859 0.362 . . . . 0.0 110.768 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.702 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 3.9 mm? -64.05 -49.56 71.87 Favored 'General case' 0 N--CA 1.429 -1.52 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.224 179.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 83.4 mt -70.07 -39.74 77.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.259 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -67.96 -15.33 63.56 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 48.7 p -108.13 -40.89 5.07 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 119.756 -0.778 . . . . 0.0 110.324 179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 94.42 43.45 3.71 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.378 -0.915 . . . . 0.0 112.652 176.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 110.84 -33.42 5.91 Favored Glycine 0 C--N 1.334 0.467 0 C-N-CA 120.343 -0.932 . . . . 0.0 112.271 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.96 87.51 1.33 Allowed 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 178.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.629 HD12 ' HG3' ' A' ' 553' ' ' GLN . 0.6 OUTLIER -77.62 -27.0 15.28 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.425 -176.836 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 577' ' ' ASN . . . . . 0.683 ' HA ' HG13 ' A' ' 580' ' ' ILE . 0.9 OUTLIER -68.84 -53.64 20.27 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 179.867 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -58.44 -29.87 66.49 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 114.249 -1.341 . . . . 0.0 107.76 176.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . 0.651 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -74.82 -27.44 60.29 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 114.12 -1.4 . . . . 0.0 110.929 179.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 580' ' ' ILE . . . . . 0.683 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.3 mt -69.51 -43.42 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-O 121.081 0.467 . . . . 0.0 110.604 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . 0.673 ' HA ' HD23 ' A' ' 584' ' ' LEU . 41.6 tt0 -69.49 -38.02 77.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.217 -178.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 582' ' ' ARG . . . . . 0.65 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -75.41 -32.12 60.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.497 -179.335 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 583' ' ' LEU . . . . . 0.938 HD22 HD13 ' A' ' 554' ' ' LEU . 8.1 tp -72.14 -31.89 66.41 Favored 'General case' 0 N--CA 1.428 -1.551 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.79 -178.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 584' ' ' LEU . . . . . 0.697 ' HG ' ' H ' ' A' ' 586' ' ' SER . 0.1 OUTLIER -78.9 -13.57 59.72 Favored 'General case' 0 N--CA 1.408 -2.531 0 N-CA-C 107.45 -1.315 . . . . 0.0 107.45 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 96.17 -7.36 66.8 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-N 114.539 -1.209 . . . . 0.0 112.837 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . 0.697 ' H ' ' HG ' ' A' ' 584' ' ' LEU . 41.0 t 42.2 70.61 0.27 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.728 0.299 . . . . 0.0 111.257 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 48.3 t . . . . . 0 C--O 1.251 1.148 0 CA-C-O 118.136 -0.935 . . . . 0.0 111.066 -179.875 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.138 0 N-CA-C 112.529 -0.229 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' SER . . . . . 0.511 ' HB2' ' HD3' ' A' ' 538' ' ' PRO . 73.2 m -76.83 -51.44 2.23 Favored Pre-proline 0 CA--C 1.534 0.348 0 N-CA-C 111.328 0.121 . . . . 0.0 111.328 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' PRO . . . . . 0.511 ' HD3' ' HB2' ' A' ' 537' ' ' SER . 87.0 Cg_endo -79.03 70.15 7.62 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.195 1.93 . . . . 0.0 112.399 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . 0.43 ' HB2' HG21 ' A' ' 545' ' ' VAL . 44.8 mt-10 -45.98 120.43 2.71 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.158 0.504 . . . . 0.0 111.816 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -99.2 1.51 44.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.702 179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 6.2 tp60 -72.22 -56.0 6.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.711 -175.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -127.38 153.08 77.17 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.739 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . 0.585 ' HA ' HD12 ' A' ' 566' ' ' LEU . 79.1 Cg_endo -78.02 12.78 1.9 Allowed 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.727 2.284 . . . . 0.0 112.696 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 544' ' ' GLU . . . . . 0.417 ' HG3' HG23 ' A' ' 545' ' ' VAL . 12.0 pt-20 -67.4 -43.58 80.94 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 179.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 545' ' ' VAL . . . . . 0.728 ' O ' ' HG2' ' A' ' 546' ' ' ARG . 28.4 t -76.09 -32.36 22.85 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 114.53 -1.213 . . . . 0.0 108.003 177.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 546' ' ' ARG . . . . . 0.728 ' HG2' ' O ' ' A' ' 545' ' ' VAL . 2.2 ptt180 49.34 52.0 15.27 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.367 178.295 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 547' ' ' PHE . . . . . 0.587 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 60.38 18.63 8.29 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.043 179.02 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 548' ' ' GLN . . . . . 0.717 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.8 pt20 28.29 -76.17 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 177.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 549' ' ' GLN . . . . . 0.717 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 12.4 mm100 -72.21 -50.81 24.59 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.559 0.695 . . . . 0.0 110.897 -178.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 550' ' ' GLN . . . . . 0.587 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 10.9 mp0 -53.93 -42.18 68.54 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 178.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 551' ' ' LEU . . . . . 0.659 HD22 ' CG ' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -56.5 -40.84 75.65 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.24 176.167 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . 0.598 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 14.3 tt0 -55.4 -32.54 62.73 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.443 -179.091 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.504 ' HB3' HG21 ' A' ' 576' ' ' ILE . 0.0 OUTLIER -74.28 -58.18 3.46 Favored 'General case' 0 N--CA 1.444 -0.745 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.293 179.347 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.653 HD11 ' HB3' ' A' ' 568' ' ' ALA . 7.9 mt -55.81 -29.85 60.41 Favored 'General case' 0 C--N 1.348 0.517 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.485 177.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 44.0 t -70.26 -39.36 75.04 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 553' ' ' GLN . . . -54.26 -35.14 62.2 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.467 -0.788 . . . . 0.0 113.084 178.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 10.8 mtp -97.97 21.37 10.76 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.006 0.821 . . . . 0.0 110.801 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 119.53 -118.49 3.96 Favored Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.751 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 559' ' ' PHE . . . . . 0.402 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 83.9 m-85 28.39 108.35 0.0 OUTLIER 'General case' 0 C--O 1.232 0.17 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -106.5 12.38 29.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 113.91 -1.495 . . . . 0.0 108.86 178.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.472 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 49.5 t-20 -97.78 109.34 22.12 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.0 -1.0 . . . . 0.0 109.684 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 562' ' ' ARG . . . . . 0.619 ' HB3' ' HD2' ' A' ' 546' ' ' ARG . 27.0 mmt180 -59.33 -61.8 2.36 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.158 -178.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -35.52 64.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.843 -0.617 . . . . 0.0 112.214 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 564' ' ' ALA . . . . . 0.472 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -77.58 -25.73 50.2 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -177.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.545 ' O ' HD23 ' A' ' 569' ' ' LEU . 78.0 m-20 -71.53 -55.62 7.48 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.441 -0.504 . . . . 0.0 109.929 -179.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.665 HD12 ' HA ' ' A' ' 546' ' ' ARG . 0.3 OUTLIER -55.98 -46.0 78.78 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.248 -179.567 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 567' ' ' GLN . . . . . 0.62 HE21 ' HA ' ' A' ' 567' ' ' GLN . 0.0 OUTLIER -61.21 -42.21 98.19 Favored 'General case' 0 CA--C 1.504 -0.826 0 C-N-CA 119.359 -0.936 . . . . 0.0 112.93 -178.209 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 568' ' ' ALA . . . . . 0.653 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -62.12 -28.41 69.62 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 118.857 -1.137 . . . . 0.0 108.295 177.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.64 HD11 HD13 ' A' ' 576' ' ' ILE . 3.0 mm? -73.11 -42.97 62.36 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 41.5 mm -72.55 -36.97 55.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 571' ' ' ALA . . . . . 0.533 ' HB1' HH12 ' A' ' 582' ' ' ARG . . . -57.03 -32.32 66.06 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.959 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 33.9 p -100.18 -38.56 8.46 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 120.181 -0.608 . . . . 0.0 110.402 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 94.15 27.74 11.78 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.828 -0.701 . . . . 0.0 113.006 177.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 127.9 -31.78 3.62 Favored Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.199 -1.001 . . . . 0.0 112.419 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -75.48 77.46 2.52 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.077 -1.082 . . . . 0.0 108.077 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.651 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.6 OUTLIER -63.95 -37.25 79.28 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.811 0 CA-C-N 114.775 -1.102 . . . . 0.0 111.243 -176.598 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 577' ' ' ASN . . . . . 0.525 ' HA ' HG13 ' A' ' 580' ' ' ILE . 7.8 m-80 -63.97 -42.37 97.27 Favored 'General case' 0 N--CA 1.441 -0.879 0 O-C-N 124.207 0.942 . . . . 0.0 108.848 179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 578' ' ' ALA . . . . . 0.436 ' O ' ' HD2' ' A' ' 582' ' ' ARG . . . -64.41 -39.5 93.96 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 113.969 -1.469 . . . . 0.0 107.605 177.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . 0.696 ' HA ' ' HD3' ' A' ' 582' ' ' ARG . . . -64.12 -35.43 80.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 114.4 -1.273 . . . . 0.0 110.503 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 580' ' ' ILE . . . . . 0.651 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.4 mt -63.4 -37.16 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 CA-C-O 121.205 0.526 . . . . 0.0 110.124 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -66.63 -44.4 82.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.326 -179.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 582' ' ' ARG . . . . . 0.696 ' HD3' ' HA ' ' A' ' 579' ' ' ALA . 0.0 OUTLIER -80.46 -41.07 25.06 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.581 -0.447 . . . . 0.0 111.339 -178.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 583' ' ' LEU . . . . . 0.48 ' HB3' ' O ' ' A' ' 579' ' ' ALA . 12.8 tp -58.07 -42.04 84.7 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.703 -178.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 584' ' ' LEU . . . . . 0.488 ' HB3' ' O ' ' A' ' 580' ' ' ILE . 0.2 OUTLIER -85.29 -20.96 29.24 Favored 'General case' 0 N--CA 1.412 -2.349 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 177.85 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -59.56 -77.88 0.16 Allowed Glycine 0 C--N 1.339 0.703 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.566 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 51.4 m 59.06 -173.89 0.1 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.918 0.389 . . . . 0.0 111.228 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 48.0 t . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.93 -179.98 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.127 0 N-CA-C 112.508 -0.237 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 50.8 m -149.09 115.06 3.67 Favored Pre-proline 0 CA--C 1.531 0.217 0 O-C-N 122.994 -0.121 . . . . 0.0 110.816 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' PRO . . . . . 0.417 ' HA ' ' CD ' ' A' ' 552' ' ' GLU . 45.0 Cg_endo -68.22 159.94 51.02 Favored 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.268 1.979 . . . . 0.0 112.277 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . 0.491 ' HB3' ' HB3' ' A' ' 543' ' ' PRO . 0.3 OUTLIER 55.77 105.89 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.578 -179.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -93.71 -76.04 0.49 Allowed 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 119.695 -0.802 . . . . 0.0 112.718 -178.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -83.06 -67.69 0.77 Allowed 'General case' 0 C--O 1.232 0.166 0 C-N-CA 119.672 -0.811 . . . . 0.0 112.24 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . 0.468 ' HB2' HH12 ' A' ' 546' ' ' ARG . 19.2 m120 -141.22 111.17 6.51 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.019 179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . 0.593 ' HA ' ' HA ' ' A' ' 548' ' ' GLN . 68.7 Cg_endo -87.77 -9.18 5.71 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.224 1.949 . . . . 0.0 111.351 178.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 544' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -73.11 -32.56 65.03 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.037 -1.438 . . . . 0.0 112.024 -178.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 545' ' ' VAL . . . . . 0.549 ' HB ' ' NE ' ' A' ' 546' ' ' ARG . 60.5 t -85.07 -68.28 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -178.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 546' ' ' ARG . . . . . 0.774 ' HD2' HD22 ' A' ' 551' ' ' LEU . 0.0 OUTLIER -101.03 117.13 34.42 Favored 'General case' 0 C--O 1.219 -0.52 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -177.568 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 547' ' ' PHE . . . . . 0.627 ' HD2' HD23 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 22.95 37.37 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.224 1.564 . . . . 0.0 115.224 172.774 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 548' ' ' GLN . . . . . 0.693 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 7.9 pt20 28.31 -86.24 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 549' ' ' GLN . . . . . 0.693 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 25.7 mt-30 -73.33 -51.5 17.24 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 115.124 -0.944 . . . . 0.0 112.225 -177.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 550' ' ' GLN . . . . . 0.534 ' HB3' ' CD1' ' A' ' 569' ' ' LEU . 2.5 mp0 -51.36 -42.24 61.19 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-O 121.441 0.639 . . . . 0.0 110.759 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 551' ' ' LEU . . . . . 0.774 HD22 ' HD2' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -63.09 -39.21 94.05 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.353 177.685 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . 0.541 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 12.5 tt0 -51.78 -31.93 29.0 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.331 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.56 ' HG2' HD12 ' A' ' 576' ' ' ILE . 1.7 mp0 -75.33 -58.84 3.04 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.755 179.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.649 HD13 HD22 ' A' ' 583' ' ' LEU . 8.4 mt -55.1 -36.99 66.26 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 119.111 -1.036 . . . . 0.0 111.506 178.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 4.9 m -67.92 -37.34 81.55 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 553' ' ' GLN . . . -53.97 -34.89 61.01 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.716 -0.675 . . . . 0.0 112.803 179.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 557' ' ' MET . . . . . 0.617 ' HG3' HG21 ' A' ' 580' ' ' ILE . 40.7 mmm -83.28 28.39 0.53 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 119.08 0.855 . . . . 0.0 111.786 179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 74.44 40.84 38.66 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 115.361 0.904 . . . . 0.0 115.361 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -113.33 134.19 54.75 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 117.551 0.676 . . . . 0.0 109.943 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 93.5 mt -111.51 -1.04 15.99 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -178.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.716 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 0.2 OUTLIER -81.75 102.64 10.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.148 0.499 . . . . 0.0 110.277 179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 562' ' ' ARG . . . . . 0.594 ' HB3' ' NE ' ' A' ' 546' ' ' ARG . 18.2 mmt180 -57.94 -70.97 0.12 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.87 -178.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -49.41 -33.75 14.68 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.983 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 564' ' ' ALA . . . . . 0.716 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -76.03 -23.82 55.16 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.6 ' O ' HD23 ' A' ' 569' ' ' LEU . 86.1 m-20 -79.56 -51.0 9.86 Favored 'General case' 0 CA--C 1.512 -0.49 0 C-N-CA 120.551 -0.459 . . . . 0.0 110.268 -178.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.629 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.4 OUTLIER -58.57 -43.86 89.56 Favored 'General case' 0 N--CA 1.424 -1.728 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.232 -178.702 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -66.13 -43.48 87.0 Favored 'General case' 0 CA--C 1.503 -0.845 0 C-N-CA 119.69 -0.804 . . . . 0.0 111.796 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 568' ' ' ALA . . . . . 0.533 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -56.99 -30.03 63.8 Favored 'General case' 0 C--N 1.312 -1.056 0 C-N-CA 118.901 -1.119 . . . . 0.0 108.031 177.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.6 HD23 ' O ' ' A' ' 565' ' ' ASN . 3.2 mm? -73.83 -46.0 47.8 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 75.5 mt -71.16 -43.43 75.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.252 0 CA-C-O 121.435 0.636 . . . . 0.0 109.348 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -57.51 -24.04 53.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.086 -0.961 . . . . 0.0 111.752 179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . 0.484 HG22 ' NH2' ' A' ' 582' ' ' ARG . 35.1 p -100.66 -37.58 8.69 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 120.217 -0.593 . . . . 0.0 109.857 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 92.75 30.56 9.49 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.896 -0.593 . . . . 0.0 113.682 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 119.41 -29.85 5.99 Favored Glycine 0 C--O 1.228 -0.262 0 C-N-CA 120.361 -0.923 . . . . 0.0 112.624 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 575' ' ' ASP . . . . . 0.465 ' HB3' ' HB3' ' A' ' 578' ' ' ALA . 1.2 t0 -72.65 82.73 1.14 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 178.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.638 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -71.81 -34.92 53.18 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.705 0 CA-C-N 115.243 -0.89 . . . . 0.0 111.204 -176.874 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 577' ' ' ASN . . . . . 0.616 ' HA ' HG13 ' A' ' 580' ' ' ILE . 9.6 m-80 -64.79 -45.15 87.52 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 122.121 0.962 . . . . 0.0 108.544 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 578' ' ' ALA . . . . . 0.465 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -63.14 -31.58 72.75 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 113.6 -1.637 . . . . 0.0 107.792 177.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -75.61 -30.39 59.54 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.472 179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 580' ' ' ILE . . . . . 0.638 HG13 ' O ' ' A' ' 576' ' ' ILE . 2.7 mt -66.46 -49.62 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-O 121.383 0.611 . . . . 0.0 110.703 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . 0.707 ' HA ' HD23 ' A' ' 584' ' ' LEU . 41.5 tt0 -67.64 -33.75 75.58 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.443 -179.221 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 582' ' ' ARG . . . . . 0.484 ' NH2' HG22 ' A' ' 572' ' ' THR . 0.5 OUTLIER -76.61 -36.1 57.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.583 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 583' ' ' LEU . . . . . 0.649 HD22 HD13 ' A' ' 554' ' ' LEU . 7.9 tp -68.9 -35.32 76.72 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.188 -178.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 584' ' ' LEU . . . . . 0.707 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER -79.26 -18.77 52.12 Favored 'General case' 0 N--CA 1.415 -2.211 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.536 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 168.49 146.89 5.15 Favored Glycine 0 C--N 1.337 0.634 0 CA-C-N 115.198 -0.91 . . . . 0.0 112.927 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 46.1 t -76.51 -35.2 58.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.854 0.359 . . . . 0.0 110.798 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 62.2 p . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.344 -0.836 . . . . 0.0 110.881 179.91 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 81.1 p -110.26 122.49 38.53 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-O 120.338 0.113 . . . . 0.0 110.838 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -77.77 73.63 5.58 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.266 1.978 . . . . 0.0 112.274 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . 0.452 ' HB2' ' HG2' ' A' ' 544' ' ' GLU . 9.3 pt-20 -154.3 -52.19 0.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.884 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -50.77 -20.46 1.27 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.509 179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -74.02 -30.64 62.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.932 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . 0.684 ' O ' HG23 ' A' ' 545' ' ' VAL . 1.2 m120 -90.32 -170.24 0.24 Allowed Pre-proline 0 CA--C 1.54 0.582 0 CA-C-O 118.412 -0.804 . . . . 0.0 110.585 -178.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . 0.655 ' HD2' ' HB3' ' A' ' 542' ' ' ASN . 26.5 Cg_exo -38.82 -12.19 0.02 OUTLIER 'Trans proline' 0 C--N 1.369 1.642 0 C-N-CA 123.025 2.484 . . . . 0.0 114.705 179.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 544' ' ' GLU . . . . . 0.538 ' N ' ' O ' ' A' ' 542' ' ' ASN . 0.9 OUTLIER -59.1 -19.54 45.39 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 122.388 1.09 . . . . 0.0 108.095 176.686 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 545' ' ' VAL . . . . . 0.684 HG23 ' O ' ' A' ' 542' ' ' ASN . 74.1 t -57.62 -29.59 34.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 105.136 -2.172 . . . . 0.0 105.136 176.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 546' ' ' ARG . . . . . 0.694 ' HB3' ' HB2' ' A' ' 551' ' ' LEU . 11.3 mmt180 76.73 42.8 0.14 Allowed 'General case' 0 N--CA 1.432 -1.336 0 CA-C-N 111.342 -2.663 . . . . 0.0 114.007 176.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 547' ' ' PHE . . . . . 0.638 ' HB2' HD12 ' A' ' 566' ' ' LEU . 0.1 OUTLIER 64.1 31.01 13.7 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 117.919 -1.513 . . . . 0.0 109.085 178.076 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 548' ' ' GLN . . . . . 0.429 ' HG3' ' CG1' ' A' ' 545' ' ' VAL . 4.4 mt-30 30.92 -84.48 0.0 OUTLIER 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.64 -1.164 . . . . 0.0 113.77 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 549' ' ' GLN . . . . . 0.458 ' N ' ' O ' ' A' ' 547' ' ' PHE . 15.2 mm100 -73.32 -50.68 20.78 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.376 -1.284 . . . . 0.0 111.761 -176.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 550' ' ' GLN . . . . . 0.62 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 6.8 mp0 -49.23 -35.01 16.22 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.251 -0.886 . . . . 0.0 109.109 178.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 551' ' ' LEU . . . . . 0.694 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -65.65 -47.0 77.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.898 177.413 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . 0.583 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 6.2 tp10 -53.4 -32.71 50.8 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.821 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.653 ' HB3' HG21 ' A' ' 576' ' ' ILE . 46.8 mt-30 -71.72 -58.29 3.61 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.827 HD13 HD22 ' A' ' 583' ' ' LEU . 8.2 mt -60.38 -28.61 68.35 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 119.241 -0.984 . . . . 0.0 109.806 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . 0.419 ' OG ' HD12 ' A' ' 551' ' ' LEU . 8.0 m -70.09 -39.5 75.54 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 177.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.437 ' C ' ' H ' ' A' ' 558' ' ' GLY . . . -55.6 -26.31 43.23 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.831 178.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 557' ' ' MET . . . . . 0.619 ' HG3' HD13 ' A' ' 580' ' ' ILE . 88.9 mmm -81.53 31.34 0.35 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.578 0.704 . . . . 0.0 110.419 178.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . 0.437 ' H ' ' C ' ' A' ' 556' ' ' ALA . . . 64.96 33.33 86.96 Favored Glycine 0 CA--C 1.522 0.498 0 CA-C-N 114.578 -1.192 . . . . 0.0 113.752 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 559' ' ' PHE . . . . . . . . . . . . . 65.5 m-85 -111.55 141.71 44.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.951 0.375 . . . . 0.0 110.284 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.453 HD12 ' N ' ' A' ' 561' ' ' ASN . 3.8 pp -117.17 -34.69 4.28 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.193 -0.203 . . . . 0.0 111.446 -179.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.453 ' N ' HD12 ' A' ' 560' ' ' LEU . 45.0 t-20 -51.36 95.36 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.054 0.454 . . . . 0.0 111.232 -179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 562' ' ' ARG . . . . . 0.58 ' HB3' ' HE ' ' A' ' 546' ' ' ARG . 14.6 mmt180 -55.78 -41.88 74.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.467 -179.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -47.31 -51.29 19.69 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.886 -178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.5 -24.71 45.7 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.11 0.481 . . . . 0.0 111.016 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.782 ' O ' HD23 ' A' ' 569' ' ' LEU . 6.9 m-20 -59.89 -58.49 8.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.063 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.642 ' HB2' ' HA ' ' A' ' 546' ' ' ARG . 1.1 tp -67.13 -33.78 76.18 Favored 'General case' 0 N--CA 1.423 -1.798 0 O-C-N 122.291 -0.256 . . . . 0.0 110.837 178.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -70.56 -42.11 71.57 Favored 'General case' 0 CA--C 1.505 -0.782 0 C-N-CA 119.445 -0.902 . . . . 0.0 113.174 -178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 568' ' ' ALA . . . . . 0.586 ' HB3' ' CD1' ' A' ' 554' ' ' LEU . . . -64.92 -27.11 68.63 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 178.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.782 HD23 ' O ' ' A' ' 565' ' ' ASN . 2.9 mm? -71.24 -53.23 15.09 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.545 -178.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 69.3 mt -70.58 -36.43 65.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.059 0.457 . . . . 0.0 110.394 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -64.2 -23.99 67.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.46 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . 0.639 HG22 HH21 ' A' ' 582' ' ' ARG . 68.6 p -105.16 -40.63 5.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 119.764 -0.775 . . . . 0.0 110.512 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 98.11 43.48 2.8 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.526 -0.845 . . . . 0.0 113.59 176.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 574' ' ' GLY . . . . . 0.625 ' O ' HG12 ' A' ' 576' ' ' ILE . . . 107.7 -32.83 6.77 Favored Glycine 0 C--O 1.227 -0.282 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.452 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -65.16 90.6 0.09 Allowed 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.659 ' O ' HG13 ' A' ' 580' ' ' ILE . 1.8 mm -70.56 -34.48 57.48 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.895 -177.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 577' ' ' ASN . . . . . 0.625 ' HA ' HG13 ' A' ' 580' ' ' ILE . 1.0 OUTLIER -67.29 -50.6 59.6 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.002 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -59.24 -30.59 68.37 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 113.99 -1.459 . . . . 0.0 107.644 177.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . 0.698 ' HB1' HD11 ' A' ' 554' ' ' LEU . . . -75.28 -30.54 60.46 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 114.122 -1.399 . . . . 0.0 111.533 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 580' ' ' ILE . . . . . 0.659 HG13 ' O ' ' A' ' 576' ' ' ILE . 4.4 mt -65.97 -46.33 88.54 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-O 121.325 0.583 . . . . 0.0 110.574 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . 0.615 ' HA ' HD23 ' A' ' 584' ' ' LEU . 28.6 mm-40 -68.07 -36.56 80.05 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.815 -178.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 582' ' ' ARG . . . . . 0.639 HH21 HG22 ' A' ' 572' ' ' THR . 1.9 ttp180 -76.43 -34.53 58.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.466 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 583' ' ' LEU . . . . . 0.827 HD22 HD13 ' A' ' 554' ' ' LEU . 6.8 tp -70.45 -33.01 70.81 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.87 -179.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 584' ' ' LEU . . . . . 0.751 ' HG ' ' H ' ' A' ' 586' ' ' SER . 0.2 OUTLIER -82.99 -18.65 39.12 Favored 'General case' 0 N--CA 1.415 -2.208 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 80.54 -12.45 33.82 Favored Glycine 0 C--N 1.337 0.609 0 CA-C-N 115.286 -0.87 . . . . 0.0 113.199 179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . 0.751 ' H ' ' HG ' ' A' ' 584' ' ' LEU . 48.9 m 64.18 1.3 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.577 0.227 . . . . 0.0 111.471 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 47.5 t . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.211 -0.899 . . . . 0.0 110.934 -179.952 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 112.593 -0.203 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 74.3 p -158.88 81.61 2.68 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.647 0.26 . . . . 0.0 110.924 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.25 81.5 0.93 Allowed 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.477 2.118 . . . . 0.0 112.447 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -123.75 -45.47 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.308 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -64.48 -62.91 1.3 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.932 0.396 . . . . 0.0 110.552 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -56.82 -45.43 82.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.371 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . 0.566 HD22 ' H ' ' A' ' 544' ' ' GLU . 2.7 t30 -55.81 138.41 70.94 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.756 179.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . 0.484 ' HA ' ' CD1' ' A' ' 566' ' ' LEU . 79.3 Cg_endo -89.95 -3.32 5.5 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.83 2.353 . . . . 0.0 113.981 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 544' ' ' GLU . . . . . 0.566 ' H ' HD22 ' A' ' 542' ' ' ASN . 13.5 mm-40 -66.9 -40.47 87.75 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.385 . . . . 0.0 110.622 -179.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 545' ' ' VAL . . . . . 0.413 HG12 ' H ' ' A' ' 548' ' ' GLN . 66.3 t -62.68 -45.77 98.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.09 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 546' ' ' ARG . . . . . 0.817 ' NH1' HD22 ' A' ' 565' ' ' ASN . 0.0 OUTLIER 78.14 33.77 0.32 Allowed 'General case' 0 N--CA 1.424 -1.728 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 178.342 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 547' ' ' PHE . . . . . 0.615 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.76 31.41 7.48 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 119.419 -0.912 . . . . 0.0 111.533 177.918 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 548' ' ' GLN . . . . . 0.468 ' HA ' HD23 ' A' ' 551' ' ' LEU . 6.8 mt-30 29.15 -82.31 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.499 1.12 . . . . 0.0 113.894 179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 549' ' ' GLN . . . . . 0.476 ' N ' ' O ' ' A' ' 547' ' ' PHE . 29.6 mm-40 -72.58 -51.35 20.16 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.839 -177.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 550' ' ' GLN . . . . . 0.615 ' HB2' ' HB3' ' A' ' 547' ' ' PHE . 13.2 mp0 -50.88 -38.95 52.71 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 122.149 0.976 . . . . 0.0 108.538 178.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 551' ' ' LEU . . . . . 0.806 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -59.69 -45.56 91.73 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 114.089 -1.414 . . . . 0.0 109.707 175.487 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . 0.609 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 57.3 mt-10 -52.82 -32.73 45.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.117 -178.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.479 ' NE2' ' HA ' ' A' ' 550' ' ' GLN . 0.5 OUTLIER -76.09 -59.21 2.86 Favored 'General case' 0 C--O 1.245 0.859 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -179.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.93 HD13 HD22 ' A' ' 583' ' ' LEU . 14.4 mt -63.28 -28.97 70.39 Favored 'General case' 0 C--N 1.346 0.449 0 C-N-CA 118.591 -1.244 . . . . 0.0 110.234 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . 0.697 ' HB2' HH22 ' A' ' 546' ' ' ARG . 47.2 t -70.38 -38.19 74.68 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 177.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' A' ' 552' ' ' GLU . . . -55.47 -26.38 42.04 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.795 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 557' ' ' MET . . . . . 0.485 ' HG3' HD13 ' A' ' 580' ' ' ILE . 0.0 OUTLIER -86.22 27.53 0.91 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.369 179.002 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 43.09 43.19 5.52 Favored Glycine 0 CA--C 1.523 0.535 0 CA-C-N 115.014 -0.994 . . . . 0.0 113.27 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 559' ' ' PHE . . . . . 0.466 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 1.9 m-85 -77.18 -40.48 45.15 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 27.7 mt 66.19 8.12 5.32 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 178.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 42.5 t-20 -110.97 82.5 1.6 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.626 0.25 . . . . 0.0 110.519 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 562' ' ' ARG . . . . . 0.534 ' HD3' HH12 ' A' ' 546' ' ' ARG . 19.6 mmt180 -57.05 -31.96 65.72 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.164 0.506 . . . . 0.0 111.443 -178.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -63.33 -52.67 60.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.56 -179.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -79.52 -25.38 41.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.423 -178.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.817 HD22 ' NH1' ' A' ' 546' ' ' ARG . 81.1 m-20 -60.23 -59.5 5.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.988 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.486 ' HB2' ' CD ' ' A' ' 546' ' ' ARG . 0.3 OUTLIER -66.12 -30.65 71.18 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.502 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -71.12 -33.06 69.77 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 119.23 -0.988 . . . . 0.0 111.642 -179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 568' ' ' ALA . . . . . 0.525 ' HB3' ' CD1' ' A' ' 554' ' ' LEU . . . -71.51 -28.47 63.92 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 107.64 -1.244 . . . . 0.0 107.64 177.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.687 HD23 ' O ' ' A' ' 565' ' ' ASN . 3.3 mm? -72.13 -53.52 12.48 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.975 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 90.0 mt -66.51 -38.51 81.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.552 179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -70.42 -17.48 63.01 Favored 'General case' 0 N--CA 1.462 0.16 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 41.6 p -105.4 -40.87 5.67 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 119.414 -0.914 . . . . 0.0 110.026 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 92.84 42.1 4.51 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.886 176.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 113.14 -34.94 4.82 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.16 -1.019 . . . . 0.0 112.413 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -71.17 87.82 0.8 Allowed 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.6 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -77.25 -26.84 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.52 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.17 -176.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 577' ' ' ASN . . . . . 0.693 ' HA ' HG13 ' A' ' 580' ' ' ILE . 14.7 m-80 -68.53 -53.7 21.42 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -58.77 -29.65 66.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.053 -1.43 . . . . 0.0 107.632 177.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . 0.487 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -75.06 -27.64 60.06 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 114.121 -1.4 . . . . 0.0 110.934 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 580' ' ' ILE . . . . . 0.693 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.5 mt -68.74 -45.26 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.193 0.52 . . . . 0.0 110.398 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . 0.793 ' HA ' HD23 ' A' ' 584' ' ' LEU . 36.1 tt0 -68.32 -37.52 80.66 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.814 -178.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 582' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 582' ' ' ARG . 0.0 OUTLIER -76.26 -31.75 58.46 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.965 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 583' ' ' LEU . . . . . 0.93 HD22 HD13 ' A' ' 554' ' ' LEU . 7.5 tp -71.23 -25.67 62.59 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-O 121.306 0.574 . . . . 0.0 109.705 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 584' ' ' LEU . . . . . 0.793 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.1 OUTLIER -86.07 -27.05 24.97 Favored 'General case' 0 N--CA 1.415 -2.182 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.597 -179.78 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 130.18 -135.51 8.38 Favored Glycine 0 C--N 1.338 0.669 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.671 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 45.6 t -153.53 -0.77 0.23 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.868 0.366 . . . . 0.0 110.805 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 47.4 t . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.364 -0.827 . . . . 0.0 110.881 -179.994 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 112.477 -0.249 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' SER . . . . . . . . . . . . . 48.3 t 57.03 70.33 1.41 Allowed Pre-proline 0 C--N 1.331 -0.22 0 CA-C-O 120.566 0.222 . . . . 0.0 111.214 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -64.22 121.3 8.89 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.589 2.193 . . . . 0.0 111.918 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -121.68 -45.63 2.28 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.582 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -95.85 -13.87 23.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.835 0.35 . . . . 0.0 111.123 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -57.92 -44.07 86.65 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.37 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 31.5 m-80 -52.78 148.73 12.74 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.392 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . 0.423 ' HA ' HD13 ' A' ' 566' ' ' LEU . 57.6 Cg_endo -71.51 -8.31 22.99 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.746 2.297 . . . . 0.0 112.542 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 544' ' ' GLU . . . . . 0.507 ' HG3' ' H ' ' A' ' 545' ' ' VAL . 7.2 pt-20 -72.36 -54.05 10.56 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 545' ' ' VAL . . . . . 0.518 HG12 ' H ' ' A' ' 548' ' ' GLN . 64.3 t -66.81 -39.05 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 177.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 546' ' ' ARG . . . . . 0.827 HH11 ' HG3' ' A' ' 546' ' ' ARG . 0.0 OUTLIER 73.09 40.26 0.56 Allowed 'General case' 0 N--CA 1.422 -1.857 0 CA-C-N 114.129 -1.396 . . . . 0.0 113.024 178.232 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 547' ' ' PHE . . . . . 0.576 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 65.92 29.94 10.07 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.134 178.196 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 548' ' ' GLN . . . . . 0.518 ' H ' HG12 ' A' ' 545' ' ' VAL . 0.0 OUTLIER 30.4 -83.32 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 124.672 1.189 . . . . 0.0 113.953 179.428 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 549' ' ' GLN . . . . . 0.45 ' N ' ' O ' ' A' ' 547' ' ' PHE . 21.6 mt-30 -72.19 -50.99 23.25 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.221 -177.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 550' ' ' GLN . . . . . 0.784 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 0.9 OUTLIER -50.87 -33.05 22.3 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 122.579 1.181 . . . . 0.0 108.501 177.819 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 551' ' ' LEU . . . . . 0.802 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.1 OUTLIER -65.3 -45.08 85.78 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.438 -1.255 . . . . 0.0 109.767 175.488 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . 0.57 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 24.4 mm-40 -53.81 -37.76 63.85 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.136 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.793 HE21 HD11 ' A' ' 569' ' ' LEU . 3.5 pp0? -72.88 -56.71 4.8 Favored 'General case' 0 N--CA 1.436 -1.139 0 C-N-CA 120.336 -0.546 . . . . 0.0 112.047 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.782 ' HG ' HE22 ' A' ' 553' ' ' GLN . 11.5 mt -58.69 -29.71 66.84 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 118.359 -1.336 . . . . 0.0 110.087 178.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 47.2 t -68.95 -40.05 79.18 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -56.66 -27.38 58.49 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.982 178.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 95.6 mmm -89.94 21.97 3.39 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.708 0.766 . . . . 0.0 109.102 178.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 47.84 36.79 14.22 Favored Glycine 0 CA--C 1.522 0.499 0 CA-C-N 114.205 -1.361 . . . . 0.0 113.363 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 559' ' ' PHE . . . . . 0.516 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 0.3 OUTLIER -61.65 -42.99 99.67 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.546 -0.461 . . . . 0.0 111.672 179.351 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . . . . . . . . . 63.2 mt 63.22 1.94 1.02 Allowed 'General case' 0 C--O 1.232 0.146 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -108.04 85.55 2.14 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 562' ' ' ARG . . . . . 0.41 ' HG2' ' H ' ' A' ' 562' ' ' ARG . 24.7 mmt180 -56.05 -50.76 70.06 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.78 -178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -47.4 -51.36 20.12 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.271 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -78.94 -25.22 43.62 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.279 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.789 HD22 ' NH1' ' A' ' 546' ' ' ARG . 89.3 m-20 -60.44 -59.74 4.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.565 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.631 HD13 ' HA ' ' A' ' 546' ' ' ARG . 2.1 tp -62.04 -29.49 70.32 Favored 'General case' 0 N--CA 1.421 -1.875 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 567' ' ' GLN . . . . . 0.517 HE21 ' HA ' ' A' ' 567' ' ' GLN . 0.1 OUTLIER -68.1 -33.98 75.54 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.171 179.099 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 568' ' ' ALA . . . . . 0.568 ' HB3' HD11 ' A' ' 554' ' ' LEU . . . -75.94 -43.34 45.38 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.809 0.338 . . . . 0.0 110.913 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.793 HD11 HE21 ' A' ' 553' ' ' GLN . 3.9 mm? -58.99 -48.56 81.15 Favored 'General case' 0 N--CA 1.426 -1.662 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.021 179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 84.1 mt -71.78 -40.67 69.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.244 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 571' ' ' ALA . . . . . 0.464 ' HB2' ' O ' ' A' ' 567' ' ' GLN . . . -58.76 -19.45 40.64 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.117 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . . . . . . . . . 25.3 p -114.57 -39.92 3.69 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.659 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 89.32 46.44 4.38 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.059 177.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 574' ' ' GLY . . . . . 0.58 ' O ' HG12 ' A' ' 576' ' ' ILE . . . 109.57 -26.97 13.06 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.337 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.55 86.7 0.64 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.627 ' O ' HG13 ' A' ' 580' ' ' ILE . 7.2 mm -68.1 -44.77 84.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.204 -176.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 577' ' ' ASN . . . . . 0.549 ' HA ' HG13 ' A' ' 580' ' ' ILE . 10.9 m-80 -67.28 -53.58 28.52 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.391 -177.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -57.85 -31.0 66.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.686 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 583' ' ' LEU . . . -75.31 -29.32 60.0 Favored 'General case' 0 C--O 1.221 -0.438 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.339 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 580' ' ' ILE . . . . . 0.627 HG13 ' O ' ' A' ' 576' ' ' ILE . 1.9 mt -69.4 -47.12 74.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-O 120.971 0.415 . . . . 0.0 111.355 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . 0.649 ' HA ' HD23 ' A' ' 584' ' ' LEU . 40.8 tt0 -69.69 -38.48 77.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.528 -178.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 582' ' ' ARG . . . . . 0.628 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -75.23 -32.15 61.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.583 -179.092 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 583' ' ' LEU . . . . . 0.628 ' N ' ' HG3' ' A' ' 582' ' ' ARG . 8.9 tp -71.69 -32.0 67.36 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.721 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 584' ' ' LEU . . . . . 0.649 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER -83.9 -15.35 48.35 Favored 'General case' 0 N--CA 1.409 -2.479 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -68.0 -83.96 0.13 Allowed Glycine 0 C--N 1.337 0.599 0 CA-C-N 114.878 -1.055 . . . . 0.0 112.565 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 35.2 t -65.93 174.61 2.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.764 0.316 . . . . 0.0 110.976 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 46.7 t . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.363 -0.827 . . . . 0.0 110.794 -179.981 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.254 0 N-CA-C 112.559 -0.216 . . . . 0.0 112.559 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' SER . . . . . 0.587 ' HB2' ' HD3' ' A' ' 538' ' ' PRO . 69.3 m -65.97 -49.78 55.88 Favored Pre-proline 0 CA--C 1.533 0.32 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' PRO . . . . . 0.587 ' HD3' ' HB2' ' A' ' 537' ' ' SER . 37.8 Cg_exo -60.99 95.09 0.11 Allowed 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 122.049 1.833 . . . . 0.0 112.109 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -50.31 78.16 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.315 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' PHE . . . . . 0.518 ' N ' ' O ' ' A' ' 538' ' ' PRO . 52.2 p90 -69.77 -6.07 29.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.717 179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -56.16 -45.81 79.54 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . . . . . . . . . 17.2 p-10 -133.05 75.31 72.06 Favored Pre-proline 0 C--N 1.331 -0.212 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . 0.477 ' O ' ' HG2' ' A' ' 546' ' ' ARG . 96.3 Cg_endo -98.13 -9.79 0.55 Allowed 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 123.331 2.687 . . . . 0.0 111.642 178.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 544' ' ' GLU . . . . . 0.548 ' HG3' ' H ' ' A' ' 545' ' ' VAL . 7.0 pt-20 -74.81 -55.13 6.14 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.819 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 545' ' ' VAL . . . . . 0.622 HG13 ' HG3' ' A' ' 548' ' ' GLN . 89.2 t -65.24 -44.02 95.2 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-N 115.285 -0.871 . . . . 0.0 108.999 178.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 546' ' ' ARG . . . . . 0.679 ' CZ ' ' HB2' ' A' ' 565' ' ' ASN . 0.0 OUTLIER 59.56 40.04 20.8 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.736 -179.983 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 547' ' ' PHE . . . . . 0.57 ' HB3' ' HB2' ' A' ' 550' ' ' GLN . 0.1 OUTLIER 66.9 15.52 10.16 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 119.302 -0.959 . . . . 0.0 109.432 -179.183 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 548' ' ' GLN . . . . . 0.622 ' HG3' HG13 ' A' ' 545' ' ' VAL . 1.5 mt-30 34.69 -79.6 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.777 177.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 549' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 547' ' ' PHE . 95.5 mt-30 -72.07 -51.9 19.41 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.071 -177.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 550' ' ' GLN . . . . . 0.638 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 2.5 mp0 -52.45 -40.49 62.33 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 115.526 -0.761 . . . . 0.0 108.991 177.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 551' ' ' LEU . . . . . 0.679 ' HA ' HH22 ' A' ' 546' ' ' ARG . 0.1 OUTLIER -60.01 -45.55 92.37 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.138 176.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . 0.611 ' N ' ' HG ' ' A' ' 551' ' ' LEU . 10.1 mm-40 -53.73 -31.8 49.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.605 -179.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.608 ' HB3' HG21 ' A' ' 576' ' ' ILE . 7.0 mt-30 -75.78 -59.02 2.94 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.577 HD22 ' CZ ' ' A' ' 559' ' ' PHE . 10.9 mt -60.68 -30.37 69.88 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 119.681 1.128 . . . . 0.0 110.041 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . 0.482 ' OG ' HD12 ' A' ' 551' ' ' LEU . 46.7 m -70.26 -42.05 72.66 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 177.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -56.48 -22.03 29.72 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.935 178.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 557' ' ' MET . . . . . . . . . . . . . 87.9 mmm -95.53 22.09 7.46 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.181 0.515 . . . . 0.0 110.408 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . . . . . . . . . . . 55.43 46.33 80.89 Favored Glycine 0 CA--C 1.52 0.372 0 CA-C-N 115.492 -0.776 . . . . 0.0 113.318 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 559' ' ' PHE . . . . . 0.651 ' CE2' ' HG ' ' A' ' 583' ' ' LEU . 0.6 OUTLIER -65.7 -42.69 90.88 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.722 0.261 . . . . 0.0 111.473 179.475 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 57.2 mt 75.42 11.35 3.37 Favored 'General case' 0 C--N 1.343 0.317 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 176.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.432 ' HB3' ' HB3' ' A' ' 564' ' ' ALA . 41.3 t-20 -146.14 95.87 2.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.834 0.35 . . . . 0.0 110.288 178.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 562' ' ' ARG . . . . . 0.575 ' HA ' ' ND2' ' A' ' 565' ' ' ASN . 22.9 mmt180 -57.14 -58.52 7.86 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.89 -178.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -53.63 -33.31 54.68 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.816 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 564' ' ' ALA . . . . . 0.432 ' HB3' ' HB3' ' A' ' 561' ' ' ASN . . . -75.71 -24.41 56.21 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.374 -178.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.679 ' HB2' ' CZ ' ' A' ' 546' ' ' ARG . 16.8 m-20 -70.84 -50.91 30.26 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.643 ' HB2' ' NE ' ' A' ' 546' ' ' ARG . 1.0 OUTLIER -51.73 -48.1 63.76 Favored 'General case' 0 N--CA 1.426 -1.646 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -54.42 -46.23 73.16 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.735 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 568' ' ' ALA . . . . . 0.542 ' HB1' ' HB1' ' A' ' 579' ' ' ALA . . . -67.34 -41.66 84.84 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 111.619 0.229 . . . . 0.0 111.619 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.743 HD11 HD11 ' A' ' 576' ' ' ILE . 3.5 mm? -63.44 -42.56 98.67 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-O 120.843 0.354 . . . . 0.0 111.921 -179.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 30.7 mm -64.44 -35.13 73.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.173 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -87.53 -17.12 32.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.105 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . 0.608 ' HB ' ' HB3' ' A' ' 575' ' ' ASP . 76.4 p -106.43 0.82 25.11 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 53.7 30.73 44.14 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.931 -0.652 . . . . 0.0 113.773 179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 102.52 -2.16 49.69 Favored Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.891 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 575' ' ' ASP . . . . . 0.608 ' HB3' ' HB ' ' A' ' 572' ' ' THR . 2.6 t0 -77.75 77.73 4.26 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.743 HD11 HD11 ' A' ' 569' ' ' LEU . 10.4 mm -58.18 -35.08 51.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 114.283 -1.326 . . . . 0.0 110.941 -177.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 577' ' ' ASN . . . . . 0.633 ' HA ' HG13 ' A' ' 580' ' ' ILE . 5.9 m-80 -67.76 -45.14 75.77 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 114.444 -1.253 . . . . 0.0 110.036 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 578' ' ' ALA . . . . . 0.51 ' HB3' ' HB3' ' A' ' 575' ' ' ASP . . . -61.88 -34.49 76.11 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.502 178.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . 0.542 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -71.83 -30.98 66.06 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.893 -1.048 . . . . 0.0 110.915 179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 580' ' ' ILE . . . . . 0.633 HG13 ' HA ' ' A' ' 577' ' ' ASN . 3.5 mt -61.1 -56.82 15.34 Favored 'Isoleucine or valine' 0 C--O 1.241 0.616 0 CA-C-O 121.364 0.602 . . . . 0.0 110.839 179.525 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -65.36 -29.66 70.41 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.121 -0.945 . . . . 0.0 111.116 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 582' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 578' ' ' ALA . 1.1 ttt180 -77.13 -47.64 19.87 Favored 'General case' 0 N--CA 1.447 -0.59 0 N-CA-C 112.951 0.723 . . . . 0.0 112.951 -179.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 583' ' ' LEU . . . . . 0.651 ' HG ' ' CE2' ' A' ' 559' ' ' PHE . 3.3 tm? -53.49 -58.04 8.56 Favored 'General case' 0 N--CA 1.416 -2.162 0 CA-C-O 121.212 0.529 . . . . 0.0 110.938 -178.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 584' ' ' LEU . . . . . . . . . . . . . 3.5 mt -79.46 -3.41 46.47 Favored 'General case' 0 N--CA 1.394 -3.245 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.178 -179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -94.52 -99.11 1.65 Allowed Glycine 0 C--N 1.342 0.877 0 C-N-CA 120.514 -0.85 . . . . 0.0 112.711 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 32.7 m 69.71 1.49 3.42 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 122.38 0.272 . . . . 0.0 111.292 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 49.5 m . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.331 -0.842 . . . . 0.0 111.159 179.912 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.259 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' SER . . . . . 0.675 ' H ' ' HD2' ' A' ' 538' ' ' PRO . 43.4 t -162.47 -52.71 0.01 OUTLIER Pre-proline 0 CA--C 1.533 0.325 0 N-CA-C 111.238 0.088 . . . . 0.0 111.238 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' PRO . . . . . 0.675 ' HD2' ' H ' ' A' ' 537' ' ' SER . 55.4 Cg_endo -69.85 -35.42 12.43 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 121.885 1.723 . . . . 0.0 112.202 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 49.82 104.16 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.531 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -99.64 -7.95 25.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.886 0.374 . . . . 0.0 110.373 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -60.33 -25.99 66.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.09 -179.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' ASN . . . . . 0.64 ' HB3' ' HD2' ' A' ' 543' ' ' PRO . 0.9 OUTLIER -60.35 178.12 0.27 Allowed Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.052 179.717 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' PRO . . . . . 0.64 ' HD2' ' HB3' ' A' ' 542' ' ' ASN . 86.1 Cg_exo -48.27 -13.46 0.24 Allowed 'Trans proline' 0 C--N 1.357 1.021 0 C-N-CA 121.894 1.729 . . . . 0.0 111.504 177.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 544' ' ' GLU . . . . . 0.454 ' H ' ' C ' ' A' ' 542' ' ' ASN . 40.3 mt-10 -53.89 -25.74 21.55 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 113.854 -1.521 . . . . 0.0 108.097 178.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 545' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 542' ' ' ASN . 77.9 t -54.53 -57.41 6.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 114.295 -1.32 . . . . 0.0 109.086 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 546' ' ' ARG . . . . . 0.73 ' O ' ' HB3' ' A' ' 551' ' ' LEU . 10.4 mmt180 -116.95 127.2 53.98 Favored 'General case' 0 C--O 1.223 -0.298 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.461 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 547' ' ' PHE . . . . . 0.673 ' HB2' ' HG ' ' A' ' 566' ' ' LEU . 0.1 OUTLIER 32.4 37.85 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 176.712 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 548' ' ' GLN . . . . . 0.69 ' HG3' ' H ' ' A' ' 549' ' ' GLN . 4.7 pt20 23.87 -84.12 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.299 1.04 . . . . 0.0 113.631 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 549' ' ' GLN . . . . . 0.69 ' H ' ' HG3' ' A' ' 548' ' ' GLN . 4.5 pt20 -73.76 -50.33 21.16 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.386 -0.825 . . . . 0.0 112.635 -177.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 550' ' ' GLN . . . . . 0.771 ' HB3' ' HG ' ' A' ' 569' ' ' LEU . 1.3 mm100 -50.09 -44.09 51.76 Favored 'General case' 0 C--O 1.25 1.082 0 CA-C-O 121.654 0.74 . . . . 0.0 111.541 -178.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 551' ' ' LEU . . . . . 0.768 HD13 HD22 ' A' ' 565' ' ' ASN . 0.1 OUTLIER -72.64 -34.27 67.18 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.6 -179.971 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -52.17 -32.24 35.19 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 553' ' ' GLN . . . . . 0.508 ' NE2' ' O ' ' A' ' 549' ' ' GLN . 1.7 mp0 -74.39 -58.53 3.23 Favored 'General case' 0 C--O 1.247 0.935 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.02 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.941 HD13 HD22 ' A' ' 583' ' ' LEU . 12.5 mt -60.38 -29.29 68.84 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 118.59 -1.244 . . . . 0.0 110.775 179.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . 0.436 ' HB2' ' CD1' ' A' ' 551' ' ' LEU . 25.3 t -70.18 -37.4 75.13 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 553' ' ' GLN . . . -55.14 -27.98 49.38 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.794 178.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 557' ' ' MET . . . . . 0.466 ' O ' ' SD ' ' A' ' 557' ' ' MET . 0.0 OUTLIER -81.73 19.51 1.06 Allowed 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 122.586 1.184 . . . . 0.0 109.111 178.642 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 558' ' ' GLY . . . . . 0.424 ' H ' ' C ' ' A' ' 556' ' ' ALA . . . 52.81 48.97 56.08 Favored Glycine 0 CA--C 1.524 0.61 0 CA-C-N 114.723 -1.126 . . . . 0.0 113.57 -178.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 559' ' ' PHE . . . . . 0.569 ' CE1' ' HG ' ' A' ' 583' ' ' LEU . 0.8 OUTLIER -74.86 -36.82 62.32 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 179.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 560' ' ' LEU . . . . . 0.544 ' HB2' ' O ' ' A' ' 559' ' ' PHE . 56.5 mt 74.0 3.54 4.44 Favored 'General case' 0 CA--C 1.529 0.156 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 178.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -125.6 95.54 4.48 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 562' ' ' ARG . . . . . 0.509 ' HB2' ' HE ' ' A' ' 546' ' ' ARG . 8.2 mmm180 -60.2 -63.15 1.4 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.743 -0.662 . . . . 0.0 112.374 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 563' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -50.17 -38.58 40.33 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 121.143 0.497 . . . . 0.0 111.934 -179.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 564' ' ' ALA . . . . . . . . . . . . . . . -68.73 -24.96 64.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.779 -178.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.768 HD22 HD13 ' A' ' 551' ' ' LEU . 29.6 m-20 -80.26 -51.17 9.24 Favored 'General case' 0 CA--C 1.508 -0.664 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -178.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 566' ' ' LEU . . . . . 0.721 ' HB2' ' HB3' ' A' ' 546' ' ' ARG . 0.5 OUTLIER -51.5 -36.45 44.68 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -177.925 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 567' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -68.57 -42.84 77.73 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.564 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 568' ' ' ALA . . . . . 0.524 ' HB1' ' HB1' ' A' ' 579' ' ' ALA . . . -61.53 -28.35 69.26 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.257 -0.977 . . . . 0.0 108.763 176.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.771 ' HG ' ' HB3' ' A' ' 550' ' ' GLN . 4.3 mm? -72.54 -52.08 17.18 Favored 'General case' 0 N--CA 1.424 -1.752 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.47 -178.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 570' ' ' ILE . . . . . . . . . . . . . 89.1 mt -67.8 -39.5 82.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.175 0.512 . . . . 0.0 109.779 178.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 571' ' ' ALA . . . . . . . . . . . . . . . -63.19 -19.64 64.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.564 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 572' ' ' THR . . . . . 0.413 HG21 ' HB2' ' A' ' 579' ' ' ALA . 34.6 p -108.23 -39.57 5.43 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 119.739 -0.785 . . . . 0.0 110.31 179.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 573' ' ' GLY . . . . . . . . . . . . . . . 91.07 39.77 5.67 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.859 -0.686 . . . . 0.0 113.179 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 574' ' ' GLY . . . . . . . . . . . . . . . 114.93 -30.18 6.99 Favored Glycine 0 C--N 1.333 0.391 0 C-N-CA 120.32 -0.943 . . . . 0.0 112.676 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 575' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -75.89 85.94 2.84 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 179.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 576' ' ' ILE . . . . . 0.602 ' O ' HG13 ' A' ' 580' ' ' ILE . 0.3 OUTLIER -73.99 -28.14 23.36 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.664 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.931 -177.244 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 577' ' ' ASN . . . . . 0.661 ' HA ' HG13 ' A' ' 580' ' ' ILE . 14.7 m-80 -68.73 -53.28 22.95 Favored 'General case' 0 C--N 1.322 -0.614 0 O-C-N 124.257 0.973 . . . . 0.0 108.722 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 578' ' ' ALA . . . . . . . . . . . . . . . -60.08 -30.04 68.97 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.258 -1.337 . . . . 0.0 107.756 177.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . 0.524 ' HB1' ' HB1' ' A' ' 568' ' ' ALA . . . -74.25 -28.89 61.44 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 114.261 -1.336 . . . . 0.0 110.777 179.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 580' ' ' ILE . . . . . 0.661 HG13 ' HA ' ' A' ' 577' ' ' ASN . 2.2 mt -67.01 -42.38 88.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-O 121.302 0.572 . . . . 0.0 110.286 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 581' ' ' GLU . . . . . 0.637 ' HA ' HD23 ' A' ' 584' ' ' LEU . 37.7 tt0 -69.89 -40.49 75.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.173 -0.922 . . . . 0.0 111.826 -178.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 582' ' ' ARG . . . . . 0.632 ' HG3' ' N ' ' A' ' 583' ' ' LEU . 0.0 OUTLIER -76.32 -35.14 58.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.148 -178.554 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 583' ' ' LEU . . . . . 0.941 HD22 HD13 ' A' ' 554' ' ' LEU . 13.4 tp -71.45 -32.24 68.1 Favored 'General case' 0 N--CA 1.428 -1.548 0 CA-C-O 121.072 0.463 . . . . 0.0 110.371 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 584' ' ' LEU . . . . . 0.637 HD23 ' HA ' ' A' ' 581' ' ' GLU . 0.2 OUTLIER -83.91 -16.87 42.7 Favored 'General case' 0 N--CA 1.41 -2.43 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 179.489 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -99.43 -0.68 56.78 Favored Glycine 0 C--N 1.338 0.663 0 CA-C-N 114.745 -1.116 . . . . 0.0 112.385 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 586' ' ' SER . . . . . . . . . . . . . 9.8 t -77.26 -157.48 0.09 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.58 0.229 . . . . 0.0 110.588 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 587' ' ' SER . . . . . . . . . . . . . 60.6 m . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.858 179.91 . . . . . . . . 0 0 . 1 stop_ save_